4-[[4-[3-(3-chloranyl-4-methyl-phenyl)propanoyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[3-(3-chloranyl-4-methyl-phenyl)propanoyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[3-(3-chloro-4-methyl-phenyl)propanoyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[3-(3-chloro-4-methylphenyl)-1-oxopropyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[3-(3-chloro-4-methylphenyl)propanoyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[3-(3-chloro-4-methyl-phenyl)propanoyl]piperazino]methyl]benzonitrile Formula: C22H24ClN3O MolecularWeight: 381.89846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N)Cl

InChI

InChI=1S/C22H24ClN3O/c1-17-2-3-18(14-21(17)23)8-9-22(27)26-12-10-25(11-13-26)16-20-6-4-19(15-24)5-7-20/h2-7,14H,8-13,16H2,1H3