7-[[2-(4-hydroxyphenyl)-2-[(2-oxidanylidene-1,3-oxazolidin-3-yl)carbonylamino]ethanoyl]amino]-3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-[[2-(4-hydroxyphenyl)-2-[(2-oxidanylidene-1,3-oxazolidin-3-yl)carbonylamino]ethanoyl]amino]-3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-[[2-(4-hydroxyphenyl)-2-[(2-oxooxazolidine-3-carbonyl)amino]acetyl]amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-[[2-(4-hydroxyphenyl)-1-oxo-2-[[oxo-(2-oxo-3-oxazolidinyl)methyl]amino]ethyl]amino]-3-[[(1-methyl-5-tetrazolyl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-[[2-(4-hydroxyphenyl)-2-[(2-oxo-1,3-oxazolidine-3-carbonyl)amino]acetyl]amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-[[2-(4-hydroxyphenyl)-2-[(2-ketooxazolidine-3-carbonyl)amino]acetyl]amino]-8-keto-3-[[(1-methyltetrazol-5-yl)thio]methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C22H22N8O8S2 MolecularWeight: 590.58888

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCC2=C(N3C(C(C3=O)NC(=O)C(C4=CC=C(C=C4)O)NC(=O)N5CCOC5=O)SC2)C(=O)O

Isomeric SMILES

CN1C(=NN=N1)SCC2=C(N3C(C(C3=O)NC(=O)C(C4=CC=C(C=C4)O)NC(=O)N5CCOC5=O)SC2)C(=O)O

InChI

InChI=1S/C22H22N8O8S2/c1-28-21(25-26-27-28)40-9-11-8-39-18-14(17(33)30(18)15(11)19(34)35)23-16(32)13(10-2-4-12(31)5-3-10)24-20(36)29-6-7-38-22(29)37/h2-5,13-14,18,31H,6-9H2,1H3,(H,23,32)(H,24,36)(H,34,35)