Chemical ID: 7486422

CC(C(=O)NN=Cc1cccc(c1)O)Oc2ccc3ccccc3c2
Chemical ID:
7486422
Name [?]:
N-[(3-hydroxyphenyl)methyleneamino]-2-(2-naphthyloxy)propanamide
SMILES [?]:
CC(C(=O)NN=Cc1cccc(c1)O)Oc2ccc3ccccc3c2
InChi [?]:
InChI=1/C20H18N2O3/c1-14(20(24)22-21-13-15-5-4-8-18(23)11-15)25-19-10-9-16-6-2-3-7-17(16)12-19/h2-14,23H,1H3,(H,22,24)
InChi Info:
AuxInfo=1/1/N:1,21,22,10,9,20,23,11,18,17,13,25,7,2,8,19,24,12,16,3,6,5,14,4,15/rA:25cCCCONNCCCCCCCOOCCCCCCCCCC/rB:s1;s2;d3;s3;s5;w6;s7;s8;d9;s10;d11;d8s12;s12;s2;s15;s16;d17;s18;s19;d20;s21;d22;d19s23;d16s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H18N2O3
All Atoms:43
Heavy Atoms:25
Chiral Atoms:1
ZAP Information [?]
Total:8.09639
Area:558.798
Solvation:-5.87357
Coulombic:-43.8494
Bond Count [?]
All:27
Single:17
Double:10
Rotors:6
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:334.369
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:5.06
LogP (Chemaxon):4.27

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue