2-(2-methoxyphenyl)-1-oxidanylidene-N-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]isoquinoline-4-carboxamide

Systemtic Name: 2-(2-methoxyphenyl)-1-oxidanylidene-N-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]isoquinoline-4-carboxamide Openeye Name: 2-(2-methoxyphenyl)-1-oxo-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]isoquinoline-4-carboxamide CAS Name: 2-(2-methoxyphenyl)-1-oxo-N-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-4-isoquinolinecarboxamide IUPAC Name: 2-(2-methoxyphenyl)-1-oxo-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]isoquinoline-4-carboxamide Traditional Name: 1-keto-N-[2-keto-2-(4-phenylpiperazino)ethyl]-2-(2-methoxyphenyl)isoquinoline-4-carboxamide Formula: C29H28N4O4 MolecularWeight: 496.55702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C=C(C3=CC=CC=C3C2=O)C(=O)NCC(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1N2C=C(C3=CC=CC=C3C2=O)C(=O)NCC(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C29H28N4O4/c1-37-26-14-8-7-13-25(26)33-20-24(22-11-5-6-12-23(22)29(33)36)28(35)30-19-27(34)32-17-15-31(16-18-32)21-9-3-2-4-10-21/h2-14,20H,15-19H2,1H3,(H,30,35)