2-[[4-[4-(3-methoxyphenyl)piperazin-1-yl]carbonylphenoxy]methyl]benzenecarbonitrile

Systemtic Name: 2-[[4-[4-(3-methoxyphenyl)piperazin-1-yl]carbonylphenoxy]methyl]benzenecarbonitrile Openeye Name: 2-[[4-[4-(3-methoxyphenyl)piperazine-1-carbonyl]phenoxy]methyl]benzonitrile CAS Name: 2-[[4-[[4-(3-methoxyphenyl)-1-piperazinyl]-oxomethyl]phenoxy]methyl]benzonitrile IUPAC Name: 2-[[4-[4-(3-methoxyphenyl)piperazine-1-carbonyl]phenoxy]methyl]benzonitrile Traditional Name: 2-[[4-[4-(3-methoxyphenyl)piperazine-1-carbonyl]phenoxy]methyl]benzonitrile Formula: C26H25N3O3 MolecularWeight: 427.495

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4C#N

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4C#N

InChI

InChI=1S/C26H25N3O3/c1-31-25-8-4-7-23(17-25)28-13-15-29(16-14-28)26(30)20-9-11-24(12-10-20)32-19-22-6-3-2-5-21(22)18-27/h2-12,17H,13-16,19H2,1H3