N-[(2-butanoyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[(2-butanoyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[(2-butanoyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]-3,4,5-trimethoxy-benzamide CAS Name: 3,4,5-trimethoxy-N-[[2-(1-oxobutyl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]benzamide IUPAC Name: N-[(2-butanoyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[(2-butyryl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]-3,4,5-trimethoxy-benzamide Formula: C24H30N2O5 MolecularWeight: 426.5054

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCC2=CC=CC=C2C1CNC(=O)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CCCC(=O)N1CCC2=CC=CC=C2C1CNC(=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C24H30N2O5/c1-5-8-22(27)26-12-11-16-9-6-7-10-18(16)19(26)15-25-24(28)17-13-20(29-2)23(31-4)21(14-17)30-3/h6-7,9-10,13-14,19H,5,8,11-12,15H2,1-4H3,(H,25,28)