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

Systemtic Name: methyl 1-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]indole-3-carboxylate Openeye Name: methyl 1-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]indole-3-carboxylate CAS Name: 1-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]indole-3-carboxylate Traditional Name: 1-[2-(4-benzylpiperazino)-2-keto-ethyl]indole-3-carboxylic acid methyl ester Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O3/c1-29-23(28)20-16-26(21-10-6-5-9-19(20)21)17-22(27)25-13-11-24(12-14-25)15-18-7-3-2-4-8-18/h2-10,16H,11-15,17H2,1H3