4-ethoxy-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide

Systemtic Name: 4-ethoxy-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide Openeye Name: 4-ethoxy-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide CAS Name: 4-ethoxy-N-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide IUPAC Name: 4-ethoxy-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide Traditional Name: 4-ethoxy-N-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide Formula: C21H24N2O3 MolecularWeight: 352.42686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)OCC

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)OCC

InChI

InChI=1S/C21H24N2O3/c1-3-20(24)23-12-11-15-5-8-18(13-17(15)14-23)22-21(25)16-6-9-19(10-7-16)26-4-2/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,22,25)