[2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl] 5,7-dimethoxy-1H-indole-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl] 5,7-dimethoxy-1H-indole-2-carboxylate Openeye Name: [2-(benzylcarbamoylamino)-2-oxo-ethyl] 5,7-dimethoxy-1H-indole-2-carboxylate CAS Name: 5,7-dimethoxy-1H-indole-2-carboxylic acid [2-oxo-2-[[oxo-[(phenylmethyl)amino]methyl]amino]ethyl] ester IUPAC Name: [2-(benzylcarbamoylamino)-2-oxoethyl] 5,7-dimethoxy-1H-indole-2-carboxylate Traditional Name: 5,7-dimethoxy-1H-indole-2-carboxylic acid [2-(benzylcarbamoylamino)-2-keto-ethyl] ester Formula: C21H21N3O6 MolecularWeight: 411.40794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)C=C(N2)C(=O)OCC(=O)NC(=O)NCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=C2C(=C1)C=C(N2)C(=O)OCC(=O)NC(=O)NCC3=CC=CC=C3)OC

InChI

InChI=1S/C21H21N3O6/c1-28-15-8-14-9-16(23-19(14)17(10-15)29-2)20(26)30-12-18(25)24-21(27)22-11-13-6-4-3-5-7-13/h3-10,23H,11-12H2,1-2H3,(H2,22,24,25,27)