4-[4-(2-methoxyphenyl)piperazin-1-yl]-2-(2-nitrophenyl)-2-phenyl-butanenitrile

Systemtic Name: 4-[4-(2-methoxyphenyl)piperazin-1-yl]-2-(2-nitrophenyl)-2-phenyl-butanenitrile Openeye Name: 4-[4-(2-methoxyphenyl)piperazin-1-yl]-2-(2-nitrophenyl)-2-phenyl-butanenitrile CAS Name: 4-[4-(2-methoxyphenyl)-1-piperazinyl]-2-(2-nitrophenyl)-2-phenylbutanenitrile IUPAC Name: 4-[4-(2-methoxyphenyl)piperazin-1-yl]-2-(2-nitrophenyl)-2-phenylbutanenitrile Traditional Name: 4-[4-(2-methoxyphenyl)piperazino]-2-(2-nitrophenyl)-2-phenyl-butyronitrile Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C27H28N4O3/c1-34-26-14-8-7-13-25(26)30-19-17-29(18-20-30)16-15-27(21-28,22-9-3-2-4-10-22)23-11-5-6-12-24(23)31(32)33/h2-14H,15-20H2,1H3