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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CCN3C(=C(C4=C(C3=O)C=CC(=C4)OC)C5=CC=CC=C5)C#N

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CCN3C(=C(C4=C(C3=O)C=CC(=C4)OC)C5=CC=CC=C5)C#N

InChI

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