(phenylmethyl) (3S)-2-ethanoyl-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: (phenylmethyl) (3S)-2-ethanoyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: benzyl (3S)-2-acetyl-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3S)-2-acetyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (3S)-2-acetyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3S)-2-acetyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid benzyl ester Formula: C19H19NO3 MolecularWeight: 309.35906

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC2=CC=CC=C2CC1C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(=O)N1CC2=CC=CC=C2C[C@H]1C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C19H19NO3/c1-14(21)20-12-17-10-6-5-9-16(17)11-18(20)19(22)23-13-15-7-3-2-4-8-15/h2-10,18H,11-13H2,1H3/t18-/m0/s1