methyl 2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]-3,4-dihydro-1H-isoquinoline-5-carboxylate

Systemtic Name: methyl 2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]-3,4-dihydro-1H-isoquinoline-5-carboxylate Openeye Name: methyl 2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3,4-dihydro-1H-isoquinoline-5-carboxylate CAS Name: 2-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3,4-dihydro-1H-isoquinoline-5-carboxylic acid methyl ester IUPAC Name: methyl 2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3,4-dihydro-1H-isoquinoline-5-carboxylate Traditional Name: 2-[2-keto-2-(4-phenylpiperazino)ethyl]-3,4-dihydro-1H-isoquinoline-5-carboxylic acid methyl ester Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2CCN(CC2=CC=C1)CC(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C2CCN(CC2=CC=C1)CC(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H27N3O3/c1-29-23(28)21-9-5-6-18-16-24(11-10-20(18)21)17-22(27)26-14-12-25(13-15-26)19-7-3-2-4-8-19/h2-9H,10-17H2,1H3