3-methyl-5-[(4-oxidanylidenecinnolin-1-yl)methyl]furan-2-carboxylic acid

Systemtic Name: 3-methyl-5-[(4-oxidanylidenecinnolin-1-yl)methyl]furan-2-carboxylic acid Openeye Name: 3-methyl-5-[(4-oxocinnolin-1-yl)methyl]furan-2-carboxylic acid CAS Name: 3-methyl-5-[(4-oxo-1-cinnolinyl)methyl]-2-furancarboxylic acid IUPAC Name: 3-methyl-5-[(4-oxocinnolin-1-yl)methyl]furan-2-carboxylic acid Traditional Name: 5-[(4-ketocinnolin-1-yl)methyl]-3-methyl-2-furoic acid Formula: C15H12N2O4 MolecularWeight: 284.26678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)CN2C3=CC=CC=C3C(=O)C=N2)C(=O)O

Isomeric SMILES

CC1=C(OC(=C1)CN2C3=CC=CC=C3C(=O)C=N2)C(=O)O

InChI

InChI=1S/C15H12N2O4/c1-9-6-10(21-14(9)15(19)20)8-17-12-5-3-2-4-11(12)13(18)7-16-17/h2-7H,8H2,1H3,(H,19,20)