(1S,3S)-1,2,3,4-tetrahydroisoquinoline-1,3-dicarboxylic acid

Systemtic Name: (1S,3S)-1,2,3,4-tetrahydroisoquinoline-1,3-dicarboxylic acid Openeye Name: (1S,3S)-1,2,3,4-tetrahydroisoquinoline-1,3-dicarboxylic acid CAS Name: (1S,3S)-1,2,3,4-tetrahydroisoquinoline-1,3-dicarboxylic acid IUPAC Name: (1S,3S)-1,2,3,4-tetrahydroisoquinoline-1,3-dicarboxylic acid Traditional Name: (1S,3S)-1,2,3,4-tetrahydroisoquinoline-1,3-dicarboxylic acid Formula: C11H11NO4 MolecularWeight: 221.20934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO4/c13-10(14)8-5-6-3-1-2-4-7(6)9(12-8)11(15)16/h1-4,8-9,12H,5H2,(H,13,14)(H,15,16)/t8-,9-/m0/s1