(phenylmethyl) N-[1-[3-(tert-butylcarbamoyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxidanyl-4-phenyl-butyl]carbamate

Systemtic Name: (phenylmethyl) N-[1-[3-(tert-butylcarbamoyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxidanyl-4-phenyl-butyl]carbamate Openeye Name: benzyl N-[1-[3-(tert-butylcarbamoyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-hydroxy-4-phenyl-butyl]carbamate CAS Name: N-[1-[3-[(tert-butylamino)-oxomethyl]-3,4-dihydro-1H-isoquinolin-2-yl]-2-hydroxy-4-phenylbutyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[3-(tert-butylcarbamoyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-hydroxy-4-phenylbutyl]carbamate Traditional Name: N-[1-[3-(tert-butylcarbamoyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-hydroxy-4-phenyl-butyl]carbamic acid benzyl ester Formula: C32H39N3O4 MolecularWeight: 529.66976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1CC2=CC=CC=C2CN1C(C(CCC3=CC=CC=C3)O)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)NC(=O)C1CC2=CC=CC=C2CN1C(C(CCC3=CC=CC=C3)O)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C32H39N3O4/c1-32(2,3)34-30(37)27-20-25-16-10-11-17-26(25)21-35(27)29(28(36)19-18-23-12-6-4-7-13-23)33-31(38)39-22-24-14-8-5-9-15-24/h4-17,27-29,36H,18-22H2,1-3H3,(H,33,38)(H,34,37)