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

Systemtic Name: 2-(2-oxidanylidenepropanoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: 2-(2-oxopropanoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: 2-(1,2-dioxopropyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: 2-(2-oxopropanoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: 2-pyruvoyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=O)N1CC2=CC=CC=C2CC1C(=O)O

Isomeric SMILES

CC(=O)C(=O)N1CC2=CC=CC=C2CC1C(=O)O

InChI

InChI=1S/C13H13NO4/c1-8(15)12(16)14-7-10-5-3-2-4-9(10)6-11(14)13(17)18/h2-5,11H,6-7H2,1H3,(H,17,18)