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

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 5,7-dimethoxy-1H-indole-2-carboxylate Openeye Name: [2-(allylcarbamoylamino)-2-oxo-ethyl] 5,7-dimethoxy-1H-indole-2-carboxylate CAS Name: 5,7-dimethoxy-1H-indole-2-carboxylic acid [2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] 5,7-dimethoxy-1H-indole-2-carboxylate Traditional Name: 5,7-dimethoxy-1H-indole-2-carboxylic acid [2-(allylcarbamoylamino)-2-keto-ethyl] ester Formula: C17H19N3O6 MolecularWeight: 361.34926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O6/c1-4-5-18-17(23)20-14(21)9-26-16(22)12-7-10-6-11(24-2)8-13(25-3)15(10)19-12/h4,6-8,19H,1,5,9H2,2-3H3,(H2,18,20,21,23)