(2-azanyl-4,5-dimethoxy-phenyl)carbonyl 2-(phenylcarbonyloxymethyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: (2-azanyl-4,5-dimethoxy-phenyl)carbonyl 2-(phenylcarbonyloxymethyl)-1,2,3-triazole-4-carboxylate Openeye Name: (2-amino-4,5-dimethoxy-benzoyl) 2-(benzoyloxymethyl)triazole-4-carboxylate CAS Name: 2-(benzoyloxymethyl)-4-triazolecarboxylic acid [(2-amino-4,5-dimethoxyphenyl)-oxomethyl] ester IUPAC Name: (2-amino-4,5-dimethoxybenzoyl) 2-(benzoyloxymethyl)triazole-4-carboxylate Traditional Name: 2-(benzoyloxymethyl)triazole-4-carboxylic acid (2-amino-4,5-dimethoxy-benzoyl) ester Formula: C20H18N4O7 MolecularWeight: 426.37952

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC(=O)C2=NN(N=C2)COC(=O)C3=CC=CC=C3)N)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC(=O)C2=NN(N=C2)COC(=O)C3=CC=CC=C3)N)OC

InChI

InChI=1S/C20H18N4O7/c1-28-16-8-13(14(21)9-17(16)29-2)19(26)31-20(27)15-10-22-24(23-15)11-30-18(25)12-6-4-3-5-7-12/h3-10H,11,21H2,1-2H3