3-methyl-7-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-5-yl)carbonylamino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 3-methyl-7-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-5-yl)carbonylamino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 3-methyl-7-[(3-methyl-2-oxo-1,3-benzoxazole-5-carbonyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 3-methyl-7-[[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)-oxomethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 3-methyl-7-[(3-methyl-2-oxo-1,3-benzoxazole-5-carbonyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 8-keto-7-[(2-keto-3-methyl-1,3-benzoxazole-5-carbonyl)amino]-3-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C17H15N3O6S MolecularWeight: 389.3825

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(C(C2=O)NC(=O)C3=CC4=C(C=C3)OC(=O)N4C)SC1)C(=O)O

Isomeric SMILES

CC1=C(N2C(C(C2=O)NC(=O)C3=CC4=C(C=C3)OC(=O)N4C)SC1)C(=O)O

InChI

InChI=1S/C17H15N3O6S/c1-7-6-27-15-11(14(22)20(15)12(7)16(23)24)18-13(21)8-3-4-10-9(5-8)19(2)17(25)26-10/h3-5,11,15H,6H2,1-2H3,(H,18,21)(H,23,24)