4-butyl-N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]cyclohexane-1-carboxamide

Systemtic Name: 4-butyl-N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]cyclohexane-1-carboxamide Openeye Name: 4-butyl-N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]cyclohexanecarboxamide CAS Name: 4-butyl-N-[2-(2-methyl-1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]-1-cyclohexanecarboxamide IUPAC Name: 4-butyl-N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]cyclohexane-1-carboxamide Traditional Name: 4-butyl-N-(2-isobutyryl-3,4-dihydro-1H-isoquinolin-7-yl)cyclohexanecarboxamide Formula: C24H36N2O2 MolecularWeight: 384.55484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)NC2=CC3=C(CCN(C3)C(=O)C(C)C)C=C2

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)NC2=CC3=C(CCN(C3)C(=O)C(C)C)C=C2

InChI

InChI=1S/C24H36N2O2/c1-4-5-6-18-7-9-20(10-8-18)23(27)25-22-12-11-19-13-14-26(16-21(19)15-22)24(28)17(2)3/h11-12,15,17-18,20H,4-10,13-14,16H2,1-3H3,(H,25,27)