1-(1-oxidanylidene-2-phenyl-spiro[4H-isoquinoline-3,1'-cyclohexane]-4-yl)carbonylpiperidine-4-carboxamide

Systemtic Name: 1-(1-oxidanylidene-2-phenyl-spiro[4H-isoquinoline-3,1'-cyclohexane]-4-yl)carbonylpiperidine-4-carboxamide Openeye Name: 1-(1-oxo-2-phenyl-spiro[4H-isoquinoline-3,1'-cyclohexane]-4-carbonyl)piperidine-4-carboxamide CAS Name: 1-[oxo-(1-oxo-2-phenyl-4-spiro[4H-isoquinoline-3,1'-cyclohexane]yl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(1-oxo-2-phenylspiro[4H-isoquinoline-3,1'-cyclohexane]-4-carbonyl)piperidine-4-carboxamide Traditional Name: 1-(1-keto-2-phenyl-spiro[4H-isoquinoline-3,1'-cyclohexane]-4-carbonyl)isonipecotamide Formula: C27H31N3O3 MolecularWeight: 445.55334

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)C(C3=CC=CC=C3C(=O)N2C4=CC=CC=C4)C(=O)N5CCC(CC5)C(=O)N

Isomeric SMILES

C1CCC2(CC1)C(C3=CC=CC=C3C(=O)N2C4=CC=CC=C4)C(=O)N5CCC(CC5)C(=O)N

InChI

InChI=1S/C27H31N3O3/c28-24(31)19-13-17-29(18-14-19)26(33)23-21-11-5-6-12-22(21)25(32)30(20-9-3-1-4-10-20)27(23)15-7-2-8-16-27/h1,3-6,9-12,19,23H,2,7-8,13-18H2,(H2,28,31)