methyl 1-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]indole-3-carboxylate

Systemtic Name: methyl 1-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]indole-3-carboxylate Openeye Name: methyl 1-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-ethyl]indole-3-carboxylate CAS Name: 1-[2-[4-(3-chlorophenyl)-1-piperazinyl]-2-oxoethyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl]indole-3-carboxylate Traditional Name: 1-[2-[4-(3-chlorophenyl)piperazino]-2-keto-ethyl]indole-3-carboxylic acid methyl ester Formula: C22H22ClN3O3 MolecularWeight: 411.88138

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H22ClN3O3/c1-29-22(28)19-14-26(20-8-3-2-7-18(19)20)15-21(27)25-11-9-24(10-12-25)17-6-4-5-16(23)13-17/h2-8,13-14H,9-12,15H2,1H3