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

Systemtic Name: (3S)-2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: (3S)-2-benzoyl-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3S)-2-benzoyl-3,4-dihydro-1H-isoquinoline-3-carboxylate IUPAC Name: (3S)-2-benzoyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3S)-2-benzoyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Formula: C17H14NO3- MolecularWeight: 280.29796

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)C(=O)C3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C17H15NO3/c19-16(12-6-2-1-3-7-12)18-11-14-9-5-4-8-13(14)10-15(18)17(20)21/h1-9,15H,10-11H2,(H,20,21)/p-1/t15-/m0/s1