7-benzamido-7-methoxy-3-(methylcarbamoyloxymethyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-benzamido-7-methoxy-3-(methylcarbamoyloxymethyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-benzamido-7-methoxy-3-(methylcarbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-benzamido-7-methoxy-3-(methylcarbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-benzamido-7-methoxy-3-(methylcarbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-benzamido-8-keto-7-methoxy-3-(methylcarbamoyloxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C18H19N3O7S MolecularWeight: 421.42436

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)OCC1=C(N2C(C(C2=O)(NC(=O)C3=CC=CC=C3)OC)SC1)C(=O)O

Isomeric SMILES

CNC(=O)OCC1=C(N2C(C(C2=O)(NC(=O)C3=CC=CC=C3)OC)SC1)C(=O)O

InChI

InChI=1S/C18H19N3O7S/c1-19-17(26)28-8-11-9-29-16-18(27-2,15(25)21(16)12(11)14(23)24)20-13(22)10-6-4-3-5-7-10/h3-7,16H,8-9H2,1-2H3,(H,19,26)(H,20,22)(H,23,24)