3-nitro-4-(4-phenylpiperidin-1-yl)benzenecarbonitrile

Systemtic Name: 3-nitro-4-(4-phenylpiperidin-1-yl)benzenecarbonitrile Openeye Name: 3-nitro-4-(4-phenyl-1-piperidyl)benzonitrile CAS Name: 3-nitro-4-(4-phenyl-1-piperidinyl)benzonitrile IUPAC Name: 3-nitro-4-(4-phenylpiperidin-1-yl)benzonitrile Traditional Name: 3-nitro-4-(4-phenylpiperidino)benzonitrile Formula: C18H17N3O2 MolecularWeight: 307.34648

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC=CC=C2)C3=C(C=C(C=C3)C#N)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C2=CC=CC=C2)C3=C(C=C(C=C3)C#N)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O2/c19-13-14-6-7-17(18(12-14)21(22)23)20-10-8-16(9-11-20)15-4-2-1-3-5-15/h1-7,12,16H,8-11H2