1-[3,3-bis(2,4-dichlorophenyl)-3-pyridin-3-yl-propyl]-4-phenyl-piperidine-4-carbonitrile

Systemtic Name: 1-[3,3-bis(2,4-dichlorophenyl)-3-pyridin-3-yl-propyl]-4-phenyl-piperidine-4-carbonitrile Openeye Name: 1-[3,3-bis(2,4-dichlorophenyl)-3-(3-pyridyl)propyl]-4-phenyl-piperidine-4-carbonitrile CAS Name: 1-[3,3-bis(2,4-dichlorophenyl)-3-(3-pyridinyl)propyl]-4-phenyl-4-piperidinecarbonitrile IUPAC Name: 1-[3,3-bis(2,4-dichlorophenyl)-3-pyridin-3-ylpropyl]-4-phenylpiperidine-4-carbonitrile Traditional Name: 1-[3,3-bis(2,4-dichlorophenyl)-3-(3-pyridyl)propyl]-4-phenyl-isonipecotonitrile Formula: C32H27Cl4N3 MolecularWeight: 595.38888

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C#N)C2=CC=CC=C2)CCC(C3=CN=CC=C3)(C4=C(C=C(C=C4)Cl)Cl)C5=C(C=C(C=C5)Cl)Cl

Isomeric SMILES

C1CN(CCC1(C#N)C2=CC=CC=C2)CCC(C3=CN=CC=C3)(C4=C(C=C(C=C4)Cl)Cl)C5=C(C=C(C=C5)Cl)Cl

InChI

InChI=1S/C32H27Cl4N3/c33-25-8-10-27(29(35)19-25)32(24-7-4-15-38-21-24,28-11-9-26(34)20-30(28)36)14-18-39-16-12-31(22-37,13-17-39)23-5-2-1-3-6-23/h1-11,15,19-21H,12-14,16-18H2