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

Systemtic Name: 2-(2-methoxyphenyl)-1-oxidanylidene-N-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]isoquinoline-4-carboxamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]-2-(2-methoxyphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: 2-(2-methoxyphenyl)-1-oxo-N-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-4-isoquinolinecarboxamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-2-(2-methoxyphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-[2-(4-benzylpiperazino)-2-keto-ethyl]-1-keto-2-(2-methoxyphenyl)isoquinoline-4-carboxamide Formula: C30H30N4O4 MolecularWeight: 510.5836

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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)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1N2C=C(C3=CC=CC=C3C2=O)C(=O)NCC(=O)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C30H30N4O4/c1-38-27-14-8-7-13-26(27)34-21-25(23-11-5-6-12-24(23)30(34)37)29(36)31-19-28(35)33-17-15-32(16-18-33)20-22-9-3-2-4-10-22/h2-14,21H,15-20H2,1H3,(H,31,36)