4-[(4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl)carbonylamino]benzoic acid

Systemtic Name: 4-[(4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl)carbonylamino]benzoic acid Openeye Name: 4-[(4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl)amino]benzoic acid CAS Name: 4-[[(4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl)-oxomethyl]amino]benzoic acid IUPAC Name: 4-[(4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl)amino]benzoic acid Traditional Name: 4-[(4-mesyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl)amino]benzoic acid Formula: C17H16N2O6S MolecularWeight: 376.38374

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC(OC2=CC=CC=C21)C(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CS(=O)(=O)N1CC(OC2=CC=CC=C21)C(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C17H16N2O6S/c1-26(23,24)19-10-15(25-14-5-3-2-4-13(14)19)16(20)18-12-8-6-11(7-9-12)17(21)22/h2-9,15H,10H2,1H3,(H,18,20)(H,21,22)