3-[4-[8-(4-methylphenyl)quinolin-2-yl]piperazin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 3-[4-[8-(4-methylphenyl)quinolin-2-yl]piperazin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 3-[4-[8-(p-tolyl)-2-quinolyl]piperazine-1-carbonyl]benzonitrile CAS Name: 3-[[4-[8-(4-methylphenyl)-2-quinolinyl]-1-piperazinyl]-oxomethyl]benzonitrile IUPAC Name: 3-[4-[8-(4-methylphenyl)quinolin-2-yl]piperazine-1-carbonyl]benzonitrile Traditional Name: 3-[4-[8-(p-tolyl)-2-quinolyl]piperazine-1-carbonyl]benzonitrile Formula: C28H24N4O MolecularWeight: 432.51636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=CC3=C2N=C(C=C3)N4CCN(CC4)C(=O)C5=CC=CC(=C5)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=CC3=C2N=C(C=C3)N4CCN(CC4)C(=O)C5=CC=CC(=C5)C#N

InChI

InChI=1S/C28H24N4O/c1-20-8-10-22(11-9-20)25-7-3-5-23-12-13-26(30-27(23)25)31-14-16-32(17-15-31)28(33)24-6-2-4-21(18-24)19-29/h2-13,18H,14-17H2,1H3