Chemical ID: 4534342

CCOc1cc(ccc1O)C=NNC(=O)c2ccc3ccccc3c2
Chemical ID:
4534342
Name [?]:
N-[(3-ethoxy-4-hydroxy-phenyl)methyleneamino]naphthalene-2-carboxamide
SMILES [?]:
CCOc1cc(ccc1O)C=NNC(=O)c2ccc3ccccc3c2
InChi [?]:
InChI=1/C20H18N2O3/c1-2-25-19-11-14(7-10-18(19)23)13-21-22-20(24)17-9-8-15-5-3-4-6-16(15)12-17/h3-13,23H,2H2,1H3,(H,22,24)
InChi Info:
AuxInfo=1/1/N:1,2,21,22,20,23,7,18,17,8,5,25,11,6,19,24,16,9,4,14,12,13,10,15,3/rA:25nCCOCCCCCCOCNNCOCCCCCCCCCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s6;w11;s12;s13;d14;s14;s16;d17;s18;s19;d20;s21;d22;d19s23;d16s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H18N2O3
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:8.31408
Area:553.199
Solvation:-5.51589
Coulombic:-44.1657
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:5.19
LogP (Chemaxon):4.05

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