3-(3-methylphenyl)-N-[2-[(1-oxidanylcyclohexyl)methyl]-1-oxidanylidene-isoquinolin-5-yl]propanamide

Systemtic Name: 3-(3-methylphenyl)-N-[2-[(1-oxidanylcyclohexyl)methyl]-1-oxidanylidene-isoquinolin-5-yl]propanamide Openeye Name: N-[2-[(1-hydroxycyclohexyl)methyl]-1-oxo-5-isoquinolyl]-3-(m-tolyl)propanamide CAS Name: N-[2-[(1-hydroxycyclohexyl)methyl]-1-oxo-5-isoquinolinyl]-3-(3-methylphenyl)propanamide IUPAC Name: N-[2-[(1-hydroxycyclohexyl)methyl]-1-oxoisoquinolin-5-yl]-3-(3-methylphenyl)propanamide Traditional Name: N-[2-[(1-hydroxycyclohexyl)methyl]-1-keto-5-isoquinolyl]-3-(m-tolyl)propionamide Formula: C26H30N2O3 MolecularWeight: 418.528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CCC(=O)NC2=CC=CC3=C2C=CN(C3=O)CC4(CCCCC4)O

Isomeric SMILES

CC1=CC(=CC=C1)CCC(=O)NC2=CC=CC3=C2C=CN(C3=O)CC4(CCCCC4)O

InChI

InChI=1S/C26H30N2O3/c1-19-7-5-8-20(17-19)11-12-24(29)27-23-10-6-9-22-21(23)13-16-28(25(22)30)18-26(31)14-3-2-4-15-26/h5-10,13,16-17,31H,2-4,11-12,14-15,18H2,1H3,(H,27,29)