N-(4-oxidanylcyclohexyl)-1-oxidanylidene-2H-isoquinoline-3-carboxamide

Systemtic Name: N-(4-oxidanylcyclohexyl)-1-oxidanylidene-2H-isoquinoline-3-carboxamide Openeye Name: N-(4-hydroxycyclohexyl)-1-oxo-2H-isoquinoline-3-carboxamide CAS Name: N-(4-hydroxycyclohexyl)-1-oxo-2H-isoquinoline-3-carboxamide IUPAC Name: N-(4-hydroxycyclohexyl)-1-oxo-2H-isoquinoline-3-carboxamide Traditional Name: N-(4-hydroxycyclohexyl)-1-keto-2H-isoquinoline-3-carboxamide Formula: C16H18N2O3 MolecularWeight: 286.32572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC(=O)C2=CC3=CC=CC=C3C(=O)N2)O

Isomeric SMILES

C1CC(CCC1NC(=O)C2=CC3=CC=CC=C3C(=O)N2)O

InChI

InChI=1S/C16H18N2O3/c19-12-7-5-11(6-8-12)17-16(21)14-9-10-3-1-2-4-13(10)15(20)18-14/h1-4,9,11-12,19H,5-8H2,(H,17,21)(H,18,20)