[2-oxidanylidene-2-[(2,4,5-trimethoxyphenyl)methylamino]ethyl] 1H-indole-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(2,4,5-trimethoxyphenyl)methylamino]ethyl] 1H-indole-3-carboxylate Openeye Name: [2-oxo-2-[(2,4,5-trimethoxyphenyl)methylamino]ethyl] 1H-indole-3-carboxylate CAS Name: 1H-indole-3-carboxylic acid [2-oxo-2-[(2,4,5-trimethoxyphenyl)methylamino]ethyl] ester IUPAC Name: [2-oxo-2-[(2,4,5-trimethoxyphenyl)methylamino]ethyl] 1H-indole-3-carboxylate Traditional Name: 1H-indole-3-carboxylic acid [2-keto-2-[(2,4,5-trimethoxybenzyl)amino]ethyl] ester Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC(=O)COC(=O)C2=CNC3=CC=CC=C32)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC(=O)COC(=O)C2=CNC3=CC=CC=C32)OC)OC

InChI

InChI=1S/C21H22N2O6/c1-26-17-9-19(28-3)18(27-2)8-13(17)10-23-20(24)12-29-21(25)15-11-22-16-7-5-4-6-14(15)16/h4-9,11,22H,10,12H2,1-3H3,(H,23,24)