2-(2-azanyl-1,3-thiazol-4-yl)-N-[(2Z)-2-[(4-nitrophenyl)methoxy-oxidanyl-methylidene]-3,8-bis(oxidanylidene)-5-thia-1-azabicyclo[4.2.0]octan-7-yl]-2-oxidanylidene-ethanamide

Systemtic Name: 2-(2-azanyl-1,3-thiazol-4-yl)-N-[(2Z)-2-[(4-nitrophenyl)methoxy-oxidanyl-methylidene]-3,8-bis(oxidanylidene)-5-thia-1-azabicyclo[4.2.0]octan-7-yl]-2-oxidanylidene-ethanamide Openeye Name: 2-(2-aminothiazol-4-yl)-N-[(2Z)-2-[hydroxy-[(4-nitrophenyl)methoxy]methylene]-3,8-dioxo-5-thia-1-azabicyclo[4.2.0]octan-7-yl]-2-oxo-acetamide CAS Name: 2-(2-amino-4-thiazolyl)-N-[(2Z)-2-[hydroxy-[(4-nitrophenyl)methoxy]methylidene]-3,8-dioxo-5-thia-1-azabicyclo[4.2.0]octan-7-yl]-2-oxoacetamide IUPAC Name: 2-(2-amino-1,3-thiazol-4-yl)-N-[(2Z)-2-[hydroxy-[(4-nitrophenyl)methoxy]methylidene]-3,8-dioxo-5-thia-1-azabicyclo[4.2.0]octan-7-yl]-2-oxoacetamide Traditional Name: 2-(2-aminothiazol-4-yl)-N-[(2Z)-2-[hydroxy-(4-nitrobenzyl)oxy-methylene]-3,8-diketo-5-thia-1-azabicyclo[4.2.0]octan-7-yl]-2-keto-acetamide Formula: C19H15N5O8S2 MolecularWeight: 505.4811

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(=C(O)OCC2=CC=C(C=C2)[N+](=O)[O-])N3C(S1)C(C3=O)NC(=O)C(=O)C4=CSC(=N4)N

Isomeric SMILES

C1C(=O)/C(=C(\O)/OCC2=CC=C(C=C2)[N+](=O)[O-])/N3C(S1)C(C3=O)NC(=O)C(=O)C4=CSC(=N4)N

InChI

InChI=1S/C19H15N5O8S2/c20-19-21-10(6-34-19)14(26)15(27)22-12-16(28)23-13(11(25)7-33-17(12)23)18(29)32-5-8-1-3-9(4-2-8)24(30)31/h1-4,6,12,17,29H,5,7H2,(H2,20,21)(H,22,27)/b18-13-