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

Systemtic Name: (phenylmethyl) (3S)-2-carbonochloridoyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: benzyl (3S)-2-chlorocarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3S)-2-carbonochloridoyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (3S)-2-carbonochloridoyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3S)-2-chlorocarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid benzyl ester Formula: C18H16ClNO3 MolecularWeight: 329.77754

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)C(=O)Cl)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1[C@H](N(CC2=CC=CC=C21)C(=O)Cl)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C18H16ClNO3/c19-18(22)20-11-15-9-5-4-8-14(15)10-16(20)17(21)23-12-13-6-2-1-3-7-13/h1-9,16H,10-12H2/t16-/m0/s1