3-(isoquinolin-3-ylcarbonylamino)-1,2-oxazole-5-carboxylic acid

Systemtic Name: 3-(isoquinolin-3-ylcarbonylamino)-1,2-oxazole-5-carboxylic acid Openeye Name: 3-(isoquinoline-3-carbonylamino)isoxazole-5-carboxylic acid CAS Name: 3-[[3-isoquinolinyl(oxo)methyl]amino]-5-isoxazolecarboxylic acid IUPAC Name: 3-(isoquinoline-3-carbonylamino)-1,2-oxazole-5-carboxylic acid Traditional Name: 3-(isoquinoline-3-carbonylamino)isoxazole-5-carboxylic acid Formula: C14H9N3O4 MolecularWeight: 283.23896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=NC(=CC2=C1)C(=O)NC3=NOC(=C3)C(=O)O

Isomeric SMILES

C1=CC=C2C=NC(=CC2=C1)C(=O)NC3=NOC(=C3)C(=O)O

InChI

InChI=1S/C14H9N3O4/c18-13(16-12-6-11(14(19)20)21-17-12)10-5-8-3-1-2-4-9(8)7-15-10/h1-7H,(H,19,20)(H,16,17,18)