3-[[3,4-bis(fluoranyl)phenyl]methyl]-4-oxidanylidene-quinazoline-6-carboxylic acid

Systemtic Name: 3-[[3,4-bis(fluoranyl)phenyl]methyl]-4-oxidanylidene-quinazoline-6-carboxylic acid Openeye Name: 3-[(3,4-difluorophenyl)methyl]-4-oxo-quinazoline-6-carboxylic acid CAS Name: 3-[(3,4-difluorophenyl)methyl]-4-oxo-6-quinazolinecarboxylic acid IUPAC Name: 3-[(3,4-difluorophenyl)methyl]-4-oxoquinazoline-6-carboxylic acid Traditional Name: 3-(3,4-difluorobenzyl)-4-keto-quinazoline-6-carboxylic acid Formula: C16H10F2N2O3 MolecularWeight: 316.259006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CN2C=NC3=C(C2=O)C=C(C=C3)C(=O)O)F)F

Isomeric SMILES

C1=CC(=C(C=C1CN2C=NC3=C(C2=O)C=C(C=C3)C(=O)O)F)F

InChI

InChI=1S/C16H10F2N2O3/c17-12-3-1-9(5-13(12)18)7-20-8-19-14-4-2-10(16(22)23)6-11(14)15(20)21/h1-6,8H,7H2,(H,22,23)