1-(carboxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid

Systemtic Name: 1-(carboxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Openeye Name: 1-(carboxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid CAS Name: 1-(carboxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid IUPAC Name: 1-(carboxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Traditional Name: 1-(carboxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C2=CC=CC=C21)CC(=O)O)C(=O)O

Isomeric SMILES

C1CN(C(C2=CC=CC=C21)CC(=O)O)C(=O)O

InChI

InChI=1S/C12H13NO4/c14-11(15)7-10-9-4-2-1-3-8(9)5-6-13(10)12(16)17/h1-4,10H,5-7H2,(H,14,15)(H,16,17)