Chemical ID: 6989069

Cc1ccc(c(c1)C)OCC(=O)NN=Cc2c3ccccc3ccc2OC
Chemical ID:
6989069
Name [?]:
2-(2,4-dimethylphenoxy)-N-[(2-methoxy-1-naphthyl)methyleneamino]acetamide
SMILES [?]:
Cc1ccc(c(c1)C)OCC(=O)NN=Cc2c3ccccc3ccc2OC
InChi [?]:
InChI=1/C22H22N2O3/c1-15-8-10-20(16(2)12-15)27-14-22(25)24-23-13-19-18-7-5-4-6-17(18)9-11-21(19)26-3/h4-13H,14H2,1-3H3,(H,24,25)
InChi Info:
AuxInfo=1/1/N:1,8,27,20,19,21,18,3,23,4,24,7,15,10,2,6,22,17,16,5,25,11,14,13,12,26,9/rA:27nCCCCCCCCOCCONNCCCCCCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;s5;s9;s10;d11;s11;s13;w14;s15;s16;s17;d18;s19;d20;d17s21;s22;d23;d16s24;s25;s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H22N2O3
All Atoms:49
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:7.06519
Area:597.467
Solvation:-7.8715
Coulombic:-32.1613
Bond Count [?]
All:29
Single:19
Double:10
Rotors:7
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:362.422
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:5.52
LogP (Chemaxon):4.7

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