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

Systemtic Name: (phenylmethyl) N-(2-cyclopropylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamate Openeye Name: benzyl N-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]carbamate CAS Name: N-[2-[cyclopropyl(oxo)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]carbamate Traditional Name: N-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]carbamic acid benzyl ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CC1C(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C21H22N2O3/c24-20(17-6-7-17)23-11-10-16-8-9-19(12-18(16)13-23)22-21(25)26-14-15-4-2-1-3-5-15/h1-5,8-9,12,17H,6-7,10-11,13-14H2,(H,22,25)