phenyl N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamate

Systemtic Name: phenyl N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamate Openeye Name: phenyl N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamate CAS Name: N-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]carbamic acid phenyl ester IUPAC Name: phenyl N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamate Traditional Name: N-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamic acid phenyl ester Formula: C19H20N2O3 MolecularWeight: 324.3737

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)OC3=CC=CC=C3

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)OC3=CC=CC=C3

InChI

InChI=1S/C19H20N2O3/c1-2-18(22)21-11-10-14-8-9-16(12-15(14)13-21)20-19(23)24-17-6-4-3-5-7-17/h3-9,12H,2,10-11,13H2,1H3,(H,20,23)