1-[(1-oxidanylidene-2H-isoquinolin-3-yl)carbonyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(1-oxidanylidene-2H-isoquinolin-3-yl)carbonyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-(1-oxo-2H-isoquinoline-3-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[oxo-(1-oxo-2H-isoquinolin-3-yl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(1-oxo-2H-isoquinoline-3-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-(1-keto-2H-isoquinoline-3-carbonyl)proline Formula: C15H14N2O4 MolecularWeight: 286.28266

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC3=CC=CC=C3C(=O)N2)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)C2=CC3=CC=CC=C3C(=O)N2)C(=O)O

InChI

InChI=1S/C15H14N2O4/c18-13-10-5-2-1-4-9(10)8-11(16-13)14(19)17-7-3-6-12(17)15(20)21/h1-2,4-5,8,12H,3,6-7H2,(H,16,18)(H,20,21)