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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCC(=O)NC2=CC=CC3=C2C=CN(C3=O)CC4(CCCCC4)O

Isomeric SMILES

CC1=CC=CC=C1CCC(=O)NC2=CC=CC3=C2C=CN(C3=O)CC4(CCCCC4)O

InChI

InChI=1S/C26H30N2O3/c1-19-8-3-4-9-20(19)12-13-24(29)27-23-11-7-10-22-21(23)14-17-28(25(22)30)18-26(31)15-5-2-6-16-26/h3-4,7-11,14,17,31H,2,5-6,12-13,15-16,18H2,1H3,(H,27,29)