Chemical ID: 7330895

c1ccc2c(c1)cccc2NC(=O)COC(=O)c3ccc(cc3O)O
Chemical ID:
7330895
Name [?]:
1-naphthylcarbamoylmethyl 2,4-dihydroxybenzoate
SMILES [?]:
c1ccc2c(c1)cccc2NC(=O)COC(=O)c3ccc(cc3O)O
InChi [?]:
InChI=1/C19H15NO5/c21-13-8-9-15(17(22)10-13)19(24)25-11-18(23)20-16-7-3-5-12-4-1-2-6-14(12)16/h1-10,21-22H,11H2,(H,20,23)
InChi Info:
AuxInfo=1/1/N:1,2,8,6,7,3,9,20,19,22,14,5,21,4,18,10,23,12,16,11,25,24,13,17,15/rA:25nCCCCCCCCCCNCOCOCOCCCCCCOO/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;d4s9;s10;s11;d12;s12;s14;s15;d16;s16;s18;d19;s20;d21;d18s22;s23;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H15NO5
All Atoms:40
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:8.2879
Area:543.976
Solvation:-5.31151
Coulombic:-72.6182
Bond Count [?]
All:27
Single:17
Double:10
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:337.326
H-Bond Donors:3
H-Bond Acceptors:6
XLogP:4.13
LogP (Chemaxon):3.76

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Descriptor Annotations

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