(phenylmethyl) N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-[1-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-methyl-butyl]carbamate CAS Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[1-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-methyl-butyl]carbamic acid benzyl ester Formula: C23H28N2O3 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCC2=CC=CC=C2C1)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCC(C)C(C(=O)N1CCC2=CC=CC=C2C1)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H28N2O3/c1-3-17(2)21(24-23(27)28-16-18-9-5-4-6-10-18)22(26)25-14-13-19-11-7-8-12-20(19)15-25/h4-12,17,21H,3,13-16H2,1-2H3,(H,24,27)