2-[4-(3,4-dichlorophenyl)carbonylpiperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-[4-(3,4-dichlorophenyl)carbonylpiperazin-1-yl]benzenecarbonitrile Openeye Name: 2-[4-(3,4-dichlorobenzoyl)piperazin-1-yl]benzonitrile CAS Name: 2-[4-[(3,4-dichlorophenyl)-oxomethyl]-1-piperazinyl]benzonitrile IUPAC Name: 2-[4-(3,4-dichlorobenzoyl)piperazin-1-yl]benzonitrile Traditional Name: 2-[4-(3,4-dichlorobenzoyl)piperazino]benzonitrile Formula: C18H15Cl2N3O MolecularWeight: 360.2372

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2C#N)C(=O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2C#N)C(=O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H15Cl2N3O/c19-15-6-5-13(11-16(15)20)18(24)23-9-7-22(8-10-23)17-4-2-1-3-14(17)12-21/h1-6,11H,7-10H2