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

Systemtic Name: 7-[(1-methoxybenzimidazol-2-yl)amino]-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-[(1-methoxybenzimidazol-2-yl)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-[(1-methoxy-2-benzimidazolyl)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-[(1-methoxybenzimidazol-2-yl)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 8-keto-7-[(1-methoxybenzimidazol-2-yl)amino]-3-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C16H16N4O4S MolecularWeight: 360.38764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(C(C2=O)NC3=NC4=CC=CC=C4N3OC)SC1)C(=O)O

Isomeric SMILES

CC1=C(N2C(C(C2=O)NC3=NC4=CC=CC=C4N3OC)SC1)C(=O)O

InChI

InChI=1S/C16H16N4O4S/c1-8-7-25-14-11(13(21)19(14)12(8)15(22)23)18-16-17-9-5-3-4-6-10(9)20(16)24-2/h3-6,11,14H,7H2,1-2H3,(H,17,18)(H,22,23)