sodium 3-(1-acetyloxyethyl)-7-methoxy-8-oxidanylidene-7-(2-thiophen-2-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: sodium 3-(1-acetyloxyethyl)-7-methoxy-8-oxidanylidene-7-(2-thiophen-2-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: sodium 3-(1-acetoxyethyl)-7-methoxy-8-oxo-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: sodium 3-(1-acetyloxyethyl)-7-methoxy-8-oxo-7-[(1-oxo-2-thiophen-2-ylethyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate IUPAC Name: sodium 3-(1-acetyloxyethyl)-7-methoxy-8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: sodium 3-(1-acetoxyethyl)-8-keto-7-methoxy-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Formula: C18H19N2NaO7S2 MolecularWeight: 462.47243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(N2C(C(C2=O)(NC(=O)CC3=CC=CS3)OC)SC1)C(=O)[O-])OC(=O)C.[Na+]

Isomeric SMILES

CC(C1=C(N2C(C(C2=O)(NC(=O)CC3=CC=CS3)OC)SC1)C(=O)[O-])OC(=O)C.[Na+]

InChI

InChI=1S/C18H20N2O7S2.Na/c1-9(27-10(2)21)12-8-29-17-18(26-3,16(25)20(17)14(12)15(23)24)19-13(22)7-11-5-4-6-28-11;/h4-6,9,17H,7-8H2,1-3H3,(H,19,22)(H,23,24);/q;+1/p-1