2-(1,2-oxazol-5-ylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: 2-(1,2-oxazol-5-ylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: 2-(isoxazole-5-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: 2-[5-isoxazolyl(oxo)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: 2-(1,2-oxazole-5-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: 2-(isoxazole-5-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C14H12N2O4 MolecularWeight: 272.25608

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)C(=O)C3=CC=NO3)C(=O)O

Isomeric SMILES

C1C(N(CC2=CC=CC=C21)C(=O)C3=CC=NO3)C(=O)O

InChI

InChI=1S/C14H12N2O4/c17-13(12-5-6-15-20-12)16-8-10-4-2-1-3-9(10)7-11(16)14(18)19/h1-6,11H,7-8H2,(H,18,19)