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

Systemtic Name: phenyl N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]carbamate Openeye Name: phenyl N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]carbamate CAS Name: N-[2-(2-methyl-1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]carbamic acid phenyl ester IUPAC Name: phenyl N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]carbamate Traditional Name: N-(2-isobutyryl-3,4-dihydro-1H-isoquinolin-7-yl)carbamic acid phenyl ester Formula: C20H22N2O3 MolecularWeight: 338.40028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O3/c1-14(2)19(23)22-11-10-15-8-9-17(12-16(15)13-22)21-20(24)25-18-6-4-3-5-7-18/h3-9,12,14H,10-11,13H2,1-2H3,(H,21,24)