N-butyl-N-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-4-pentyl-benzamide

Systemtic Name: N-butyl-N-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-4-pentyl-benzamide Openeye Name: N-butyl-N-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-4-pentyl-benzamide CAS Name: N-butyl-N-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-4-pentylbenzamide IUPAC Name: N-butyl-N-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-4-pentylbenzamide Traditional Name: 4-amyl-N-butyl-N-[2-keto-2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]benzamide Formula: C28H38N2O2 MolecularWeight: 434.61352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N(CCCC)CC(=O)N2CCC3=CC=CC=C3C2C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N(CCCC)CC(=O)N2CCC3=CC=CC=C3C2C

InChI

InChI=1S/C28H38N2O2/c1-4-6-8-11-23-14-16-25(17-15-23)28(32)29(19-7-5-2)21-27(31)30-20-18-24-12-9-10-13-26(24)22(30)3/h9-10,12-17,22H,4-8,11,18-21H2,1-3H3