1-[2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)cyclohexyl]carbonyl-4-phenyl-piperidine-4-carbonitrile

Systemtic Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)cyclohexyl]carbonyl-4-phenyl-piperidine-4-carbonitrile Openeye Name: 1-[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)cyclohexanecarbonyl]-4-phenyl-piperidine-4-carbonitrile CAS Name: 1-[[2-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]cyclohexyl]-oxomethyl]-4-phenyl-4-piperidinecarbonitrile IUPAC Name: 1-[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)cyclohexanecarbonyl]-4-phenylpiperidine-4-carbonitrile Traditional Name: 1-[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)cyclohexanecarbonyl]-4-phenyl-isonipecotonitrile Formula: C29H33N3O2 MolecularWeight: 455.59122

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)N2CCC(CC2)(C#N)C3=CC=CC=C3)C(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CCC(C(C1)C(=O)N2CCC(CC2)(C#N)C3=CC=CC=C3)C(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C29H33N3O2/c30-21-29(24-10-2-1-3-11-24)15-18-31(19-16-29)27(33)25-12-6-7-13-26(25)28(34)32-17-14-22-8-4-5-9-23(22)20-32/h1-5,8-11,25-26H,6-7,12-20H2