3,5-dimethoxy-N-[2-[(1-oxidanylcyclohexyl)methyl]-1-oxidanylidene-isoquinolin-5-yl]benzamide

Systemtic Name: 3,5-dimethoxy-N-[2-[(1-oxidanylcyclohexyl)methyl]-1-oxidanylidene-isoquinolin-5-yl]benzamide Openeye Name: N-[2-[(1-hydroxycyclohexyl)methyl]-1-oxo-5-isoquinolyl]-3,5-dimethoxy-benzamide CAS Name: N-[2-[(1-hydroxycyclohexyl)methyl]-1-oxo-5-isoquinolinyl]-3,5-dimethoxybenzamide IUPAC Name: N-[2-[(1-hydroxycyclohexyl)methyl]-1-oxoisoquinolin-5-yl]-3,5-dimethoxybenzamide Traditional Name: N-[2-[(1-hydroxycyclohexyl)methyl]-1-keto-5-isoquinolyl]-3,5-dimethoxy-benzamide Formula: C25H28N2O5 MolecularWeight: 436.50022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NC2=CC=CC3=C2C=CN(C3=O)CC4(CCCCC4)O)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NC2=CC=CC3=C2C=CN(C3=O)CC4(CCCCC4)O)OC

InChI

InChI=1S/C25H28N2O5/c1-31-18-13-17(14-19(15-18)32-2)23(28)26-22-8-6-7-21-20(22)9-12-27(24(21)29)16-25(30)10-4-3-5-11-25/h6-9,12-15,30H,3-5,10-11,16H2,1-2H3,(H,26,28)