4-(4-methyl-2-phenyl-piperazin-1-yl)carbonylbenzenecarbonitrile

Systemtic Name: 4-(4-methyl-2-phenyl-piperazin-1-yl)carbonylbenzenecarbonitrile Openeye Name: 4-(4-methyl-2-phenyl-piperazine-1-carbonyl)benzonitrile CAS Name: 4-[(4-methyl-2-phenyl-1-piperazinyl)-oxomethyl]benzonitrile IUPAC Name: 4-(4-methyl-2-phenylpiperazine-1-carbonyl)benzonitrile Traditional Name: 4-(4-methyl-2-phenyl-piperazine-1-carbonyl)benzonitrile Formula: C19H19N3O MolecularWeight: 305.37366

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(C(C1)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CN1CCN(C(C1)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H19N3O/c1-21-11-12-22(18(14-21)16-5-3-2-4-6-16)19(23)17-9-7-15(13-20)8-10-17/h2-10,18H,11-12,14H2,1H3