4-[[3-[(5-methyl-1,2-oxazol-3-yl)carbamoyl]phenyl]sulfonylamino]benzoic acid

Systemtic Name: 4-[[3-[(5-methyl-1,2-oxazol-3-yl)carbamoyl]phenyl]sulfonylamino]benzoic acid Openeye Name: 4-[[3-[(5-methylisoxazol-3-yl)carbamoyl]phenyl]sulfonylamino]benzoic acid CAS Name: 4-[[3-[[(5-methyl-3-isoxazolyl)amino]-oxomethyl]phenyl]sulfonylamino]benzoic acid IUPAC Name: 4-[[3-[(5-methyl-1,2-oxazol-3-yl)carbamoyl]phenyl]sulfonylamino]benzoic acid Traditional Name: 4-[[3-[(5-methylisoxazol-3-yl)carbamoyl]phenyl]sulfonylamino]benzoic acid Formula: C18H15N3O6S MolecularWeight: 401.3932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H15N3O6S/c1-11-9-16(20-27-11)19-17(22)13-3-2-4-15(10-13)28(25,26)21-14-7-5-12(6-8-14)18(23)24/h2-10,21H,1H3,(H,23,24)(H,19,20,22)