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

Systemtic Name: 7-methoxy-3-(methoxymethyl)-8-oxidanylidene-7-(2-phenylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-methoxy-3-(methoxymethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-methoxy-3-(methoxymethyl)-8-oxo-7-[(1-oxo-2-phenylethyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-methoxy-3-(methoxymethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 8-keto-7-methoxy-3-(methoxymethyl)-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C18H20N2O6S MolecularWeight: 392.4262

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(N2C(C(C2=O)(NC(=O)CC3=CC=CC=C3)OC)SC1)C(=O)O

Isomeric SMILES

COCC1=C(N2C(C(C2=O)(NC(=O)CC3=CC=CC=C3)OC)SC1)C(=O)O

InChI

InChI=1S/C18H20N2O6S/c1-25-9-12-10-27-17-18(26-2,16(24)20(17)14(12)15(22)23)19-13(21)8-11-6-4-3-5-7-11/h3-7,17H,8-10H2,1-2H3,(H,19,21)(H,22,23)