4-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]benzene-1,3-dicarboxylic acid

Systemtic Name: 4-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]benzene-1,3-dicarboxylic acid Openeye Name: 4-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]benzene-1,3-dicarboxylic acid CAS Name: 4-[[2-(3,4-dimethoxyphenyl)ethylamino]-oxomethyl]benzene-1,3-dicarboxylic acid IUPAC Name: 4-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]benzene-1,3-dicarboxylic acid Traditional Name: 4-(homoveratrylcarbamoyl)isophthalic acid Formula: C19H19NO7 MolecularWeight: 373.35666

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=C(C=C(C=C2)C(=O)O)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=C(C=C(C=C2)C(=O)O)C(=O)O)OC

InChI

InChI=1S/C19H19NO7/c1-26-15-6-3-11(9-16(15)27-2)7-8-20-17(21)13-5-4-12(18(22)23)10-14(13)19(24)25/h3-6,9-10H,7-8H2,1-2H3,(H,20,21)(H,22,23)(H,24,25)