6-methoxy-2-[2-[4-(3-methoxyphenyl)piperazin-1-yl]ethyl]-1-oxidanylidene-4-phenyl-isoquinoline-3-carbonitrile

Systemtic Name: 6-methoxy-2-[2-[4-(3-methoxyphenyl)piperazin-1-yl]ethyl]-1-oxidanylidene-4-phenyl-isoquinoline-3-carbonitrile Openeye Name: 6-methoxy-2-[2-[4-(3-methoxyphenyl)piperazin-1-yl]ethyl]-1-oxo-4-phenyl-isoquinoline-3-carbonitrile CAS Name: 6-methoxy-2-[2-[4-(3-methoxyphenyl)-1-piperazinyl]ethyl]-1-oxo-4-phenyl-3-isoquinolinecarbonitrile IUPAC Name: 6-methoxy-2-[2-[4-(3-methoxyphenyl)piperazin-1-yl]ethyl]-1-oxo-4-phenylisoquinoline-3-carbonitrile Traditional Name: 1-keto-6-methoxy-2-[2-[4-(3-methoxyphenyl)piperazino]ethyl]-4-phenyl-isoquinoline-3-carbonitrile Formula: C30H30N4O3 MolecularWeight: 494.5842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)N(C(=C2C3=CC=CC=C3)C#N)CCN4CCN(CC4)C5=CC(=CC=C5)OC

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)N(C(=C2C3=CC=CC=C3)C#N)CCN4CCN(CC4)C5=CC(=CC=C5)OC

InChI

InChI=1S/C30H30N4O3/c1-36-24-10-6-9-23(19-24)33-16-13-32(14-17-33)15-18-34-28(21-31)29(22-7-4-3-5-8-22)27-20-25(37-2)11-12-26(27)30(34)35/h3-12,19-20H,13-18H2,1-2H3