N-[(3,3-dimethyl-1-oxidanyl-cyclohexyl)methyl]-2-(3-methoxy-2-oxidanyl-propyl)-1-oxidanylidene-isoquinoline-5-carboxamide

Systemtic Name: N-[(3,3-dimethyl-1-oxidanyl-cyclohexyl)methyl]-2-(3-methoxy-2-oxidanyl-propyl)-1-oxidanylidene-isoquinoline-5-carboxamide Openeye Name: N-[(1-hydroxy-3,3-dimethyl-cyclohexyl)methyl]-2-(2-hydroxy-3-methoxy-propyl)-1-oxo-isoquinoline-5-carboxamide CAS Name: N-[(1-hydroxy-3,3-dimethylcyclohexyl)methyl]-2-(2-hydroxy-3-methoxypropyl)-1-oxo-5-isoquinolinecarboxamide IUPAC Name: N-[(1-hydroxy-3,3-dimethylcyclohexyl)methyl]-2-(2-hydroxy-3-methoxypropyl)-1-oxoisoquinoline-5-carboxamide Traditional Name: N-[(1-hydroxy-3,3-dimethyl-cyclohexyl)methyl]-2-(2-hydroxy-3-methoxy-propyl)-1-keto-isoquinoline-5-carboxamide Formula: C23H32N2O5 MolecularWeight: 416.51058

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC(C1)(CNC(=O)C2=CC=CC3=C2C=CN(C3=O)CC(COC)O)O)C

Isomeric SMILES

CC1(CCCC(C1)(CNC(=O)C2=CC=CC3=C2C=CN(C3=O)CC(COC)O)O)C

InChI

InChI=1S/C23H32N2O5/c1-22(2)9-5-10-23(29,14-22)15-24-20(27)18-6-4-7-19-17(18)8-11-25(21(19)28)12-16(26)13-30-3/h4,6-8,11,16,26,29H,5,9-10,12-15H2,1-3H3,(H,24,27)