3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 3-[4-(5-chloro-2-methyl-phenyl)piperazine-1-carbonyl]benzonitrile CAS Name: 3-[[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-oxomethyl]benzonitrile IUPAC Name: 3-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]benzonitrile Traditional Name: 3-[4-(5-chloro-2-methyl-phenyl)piperazine-1-carbonyl]benzonitrile Formula: C19H18ClN3O MolecularWeight: 339.81872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C19H18ClN3O/c1-14-5-6-17(20)12-18(14)22-7-9-23(10-8-22)19(24)16-4-2-3-15(11-16)13-21/h2-6,11-12H,7-10H2,1H3