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

Systemtic Name: N,4-dibutyl-N-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]benzamide Openeye Name: N,4-dibutyl-N-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]benzamide CAS Name: N,4-dibutyl-N-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]benzamide IUPAC Name: N,4-dibutyl-N-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]benzamide Traditional Name: N,4-dibutyl-N-[2-keto-2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]benzamide Formula: C27H36N2O2 MolecularWeight: 420.58694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N(CCCC)CC(=O)N2CCC3=CC=CC=C3C2C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N(CCCC)CC(=O)N2CCC3=CC=CC=C3C2C

InChI

InChI=1S/C27H36N2O2/c1-4-6-10-22-13-15-24(16-14-22)27(31)28(18-7-5-2)20-26(30)29-19-17-23-11-8-9-12-25(23)21(29)3/h8-9,11-16,21H,4-7,10,17-20H2,1-3H3