4-[(5-ethylsulfonyl-2-oxidanyl-phenyl)amino]quinazoline-7-carboxylic acid

Systemtic Name: 4-[(5-ethylsulfonyl-2-oxidanyl-phenyl)amino]quinazoline-7-carboxylic acid Openeye Name: 4-(5-ethylsulfonyl-2-hydroxy-anilino)quinazoline-7-carboxylic acid CAS Name: 4-(5-ethylsulfonyl-2-hydroxyanilino)-7-quinazolinecarboxylic acid IUPAC Name: 4-(5-ethylsulfonyl-2-hydroxyanilino)quinazoline-7-carboxylic acid Traditional Name: 4-(5-esyl-2-hydroxy-anilino)quinazoline-7-carboxylic acid Formula: C17H15N3O5S MolecularWeight: 373.3831

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC2=NC=NC3=C2C=CC(=C3)C(=O)O

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC2=NC=NC3=C2C=CC(=C3)C(=O)O

InChI

InChI=1S/C17H15N3O5S/c1-2-26(24,25)11-4-6-15(21)14(8-11)20-16-12-5-3-10(17(22)23)7-13(12)18-9-19-16/h3-9,21H,2H2,1H3,(H,22,23)(H,18,19,20)