[2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl] 4-ethanoyl-1-methyl-pyrrole-2-carboxylate

Systemtic Name: [2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl] 4-ethanoyl-1-methyl-pyrrole-2-carboxylate Openeye Name: [2-[2-(1H-indol-3-yl)ethylamino]-2-oxo-ethyl] 4-acetyl-1-methyl-pyrrole-2-carboxylate CAS Name: 4-acetyl-1-methyl-2-pyrrolecarboxylic acid [2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl] 4-acetyl-1-methylpyrrole-2-carboxylate Traditional Name: 4-acetyl-1-methyl-pyrrole-2-carboxylic acid [2-[2-(1H-indol-3-yl)ethylamino]-2-keto-ethyl] ester Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN(C(=C1)C(=O)OCC(=O)NCCC2=CNC3=CC=CC=C32)C

Isomeric SMILES

CC(=O)C1=CN(C(=C1)C(=O)OCC(=O)NCCC2=CNC3=CC=CC=C32)C

InChI

InChI=1S/C20H21N3O4/c1-13(24)15-9-18(23(2)11-15)20(26)27-12-19(25)21-8-7-14-10-22-17-6-4-3-5-16(14)17/h3-6,9-11,22H,7-8,12H2,1-2H3,(H,21,25)