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

Systemtic Name: 1-oxidanylidene-2-(phenylmethyl)-N-(pyridin-3-ylmethyl)spiro[4H-isoquinoline-3,1'-cyclopentane]-4-carboxamide Openeye Name: 2-benzyl-1-oxo-N-(3-pyridylmethyl)spiro[4H-isoquinoline-3,1'-cyclopentane]-4-carboxamide CAS Name: 1-oxo-2-(phenylmethyl)-N-(3-pyridinylmethyl)-4-spiro[4H-isoquinoline-3,1'-cyclopentane]carboxamide IUPAC Name: 2-benzyl-1-oxo-N-(pyridin-3-ylmethyl)spiro[4H-isoquinoline-3,1'-cyclopentane]-4-carboxamide Traditional Name: 2-benzyl-1-keto-N-(3-pyridylmethyl)spiro[4H-isoquinoline-3,1'-cyclopentane]-4-carboxamide Formula: C27H27N3O2 MolecularWeight: 425.52218

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)C(C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)C(=O)NCC5=CN=CC=C5

Isomeric SMILES

C1CCC2(C1)C(C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C27H27N3O2/c31-25(29-18-21-11-8-16-28-17-21)24-22-12-4-5-13-23(22)26(32)30(27(24)14-6-7-15-27)19-20-9-2-1-3-10-20/h1-5,8-13,16-17,24H,6-7,14-15,18-19H2,(H,29,31)