1-oxidanylidene-2-(phenylmethyl)-N-(pyridin-3-ylmethyl)spiro[4H-isoquinoline-3,1'-cyclohexane]-4-carboxamide

Systemtic Name: 1-oxidanylidene-2-(phenylmethyl)-N-(pyridin-3-ylmethyl)spiro[4H-isoquinoline-3,1'-cyclohexane]-4-carboxamide Openeye Name: 2-benzyl-1-oxo-N-(3-pyridylmethyl)spiro[4H-isoquinoline-3,1'-cyclohexane]-4-carboxamide CAS Name: 1-oxo-2-(phenylmethyl)-N-(3-pyridinylmethyl)-4-spiro[4H-isoquinoline-3,1'-cyclohexane]carboxamide IUPAC Name: 2-benzyl-1-oxo-N-(pyridin-3-ylmethyl)spiro[4H-isoquinoline-3,1'-cyclohexane]-4-carboxamide Traditional Name: 2-benzyl-1-keto-N-(3-pyridylmethyl)spiro[4H-isoquinoline-3,1'-cyclohexane]-4-carboxamide Formula: C28H29N3O2 MolecularWeight: 439.54876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)C(C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)C(=O)NCC5=CN=CC=C5

Isomeric SMILES

C1CCC2(CC1)C(C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C28H29N3O2/c32-26(30-19-22-12-9-17-29-18-22)25-23-13-5-6-14-24(23)27(33)31(20-21-10-3-1-4-11-21)28(25)15-7-2-8-16-28/h1,3-6,9-14,17-18,25H,2,7-8,15-16,19-20H2,(H,30,32)