4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-(4-methylphenyl)propoxy]benzenecarbonitrile

Systemtic Name: 4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-(4-methylphenyl)propoxy]benzenecarbonitrile Openeye Name: 4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-(p-tolyl)propoxy]benzonitrile CAS Name: 4-[3-[4-(2-methoxyphenyl)-1-piperazinyl]-1-(4-methylphenyl)propoxy]benzonitrile IUPAC Name: 4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-(4-methylphenyl)propoxy]benzonitrile Traditional Name: 4-[3-[4-(2-methoxyphenyl)piperazino]-1-(p-tolyl)propoxy]benzonitrile Formula: C28H31N3O2 MolecularWeight: 441.56464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CCN2CCN(CC2)C3=CC=CC=C3OC)OC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C(CCN2CCN(CC2)C3=CC=CC=C3OC)OC4=CC=C(C=C4)C#N

InChI

InChI=1S/C28H31N3O2/c1-22-7-11-24(12-8-22)27(33-25-13-9-23(21-29)10-14-25)15-16-30-17-19-31(20-18-30)26-5-3-4-6-28(26)32-2/h3-14,27H,15-20H2,1-2H3