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

Systemtic Name: (phenylmethyl) N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamate Openeye Name: benzyl 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 (phenylmethyl) ester IUPAC Name: benzyl 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 benzyl ester Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)OCC3=CC=CC=C3

InChI

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