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

Systemtic Name: 2-(2-fluorophenyl)-1-oxidanylidene-N-(pyridin-3-ylmethyl)spiro[4H-isoquinoline-3,1'-cyclohexane]-4-carboxamide Openeye Name: 2-(2-fluorophenyl)-1-oxo-N-(3-pyridylmethyl)spiro[4H-isoquinoline-3,1'-cyclohexane]-4-carboxamide CAS Name: 2-(2-fluorophenyl)-1-oxo-N-(3-pyridinylmethyl)-4-spiro[4H-isoquinoline-3,1'-cyclohexane]carboxamide IUPAC Name: 2-(2-fluorophenyl)-1-oxo-N-(pyridin-3-ylmethyl)spiro[4H-isoquinoline-3,1'-cyclohexane]-4-carboxamide Traditional Name: 2-(2-fluorophenyl)-1-keto-N-(3-pyridylmethyl)spiro[4H-isoquinoline-3,1'-cyclohexane]-4-carboxamide Formula: C27H26FN3O2 MolecularWeight: 443.512643

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)C(C3=CC=CC=C3C(=O)N2C4=CC=CC=C4F)C(=O)NCC5=CN=CC=C5

Isomeric SMILES

C1CCC2(CC1)C(C3=CC=CC=C3C(=O)N2C4=CC=CC=C4F)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C27H26FN3O2/c28-22-12-4-5-13-23(22)31-26(33)21-11-3-2-10-20(21)24(27(31)14-6-1-7-15-27)25(32)30-18-19-9-8-16-29-17-19/h2-5,8-13,16-17,24H,1,6-7,14-15,18H2,(H,30,32)