1-[6-[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]-5-nitro-pyrimidin-4-yl]-4-phenyl-piperidine-4-carbonitrile

Systemtic Name: 1-[6-[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]-5-nitro-pyrimidin-4-yl]-4-phenyl-piperidine-4-carbonitrile Openeye Name: 1-[6-[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]-5-nitro-pyrimidin-4-yl]-4-phenyl-piperidine-4-carbonitrile CAS Name: 1-[6-[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]-5-nitro-4-pyrimidinyl]-4-phenyl-4-piperidinecarbonitrile IUPAC Name: 1-[6-[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]-5-nitropyrimidin-4-yl]-4-phenylpiperidine-4-carbonitrile Traditional Name: 1-[6-[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]-5-nitro-pyrimidin-4-yl]-4-phenyl-isonipecotonitrile Formula: C27H25ClN6O2 MolecularWeight: 500.9794

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1C2=CC=C(C=C2)Cl)C3=C(C(=NC=N3)N4CCC(CC4)(C#N)C5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC=C1C2=CC=C(C=C2)Cl)C3=C(C(=NC=N3)N4CCC(CC4)(C#N)C5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H25ClN6O2/c28-23-8-6-20(7-9-23)21-10-14-32(15-11-21)25-24(34(35)36)26(31-19-30-25)33-16-12-27(18-29,13-17-33)22-4-2-1-3-5-22/h1-10,19H,11-17H2