(3S)-6,7-bis(oxidanyl)-1-phenyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid

Systemtic Name: (3S)-6,7-bis(oxidanyl)-1-phenyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid Openeye Name: (3S)-6,7-dihydroxy-1-phenyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid CAS Name: (3S)-6,7-dihydroxy-1-phenyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid IUPAC Name: (3S)-6,7-dihydroxy-1-phenyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid Traditional Name: (3S)-6,7-dihydroxy-1-phenyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid Formula: C16H15NO4 MolecularWeight: 285.2946

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(C2=CC(=C(C=C21)O)O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1[C@H](NC(C2=CC(=C(C=C21)O)O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C16H15NO4/c18-13-7-10-6-12(16(20)21)17-15(11(10)8-14(13)19)9-4-2-1-3-5-9/h1-5,7-8,12,15,17-19H,6H2,(H,20,21)/t12-,15?/m0/s1