4-butoxy-N-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide

Systemtic Name: 4-butoxy-N-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide Openeye Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-butoxy-benzamide CAS Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-butoxybenzamide IUPAC Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-butoxybenzamide Traditional Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-butoxy-benzamide Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(CCN(C3)C(=O)C)C=C2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(CCN(C3)C(=O)C)C=C2

InChI

InChI=1S/C22H26N2O3/c1-3-4-13-27-21-9-6-18(7-10-21)22(26)23-20-8-5-17-11-12-24(16(2)25)15-19(17)14-20/h5-10,14H,3-4,11-13,15H2,1-2H3,(H,23,26)