7-(8-ethoxycarbonylimidazo[1,2-a]pyridin-4-ium-1-yl)-7-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: 7-(8-ethoxycarbonylimidazo[1,2-a]pyridin-4-ium-1-yl)-7-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: 7-(8-ethoxycarbonylimidazo[1,2-a]pyridin-4-ium-1-yl)-7-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-(8-ethoxycarbonyl-1-imidazo[1,2-a]pyridin-4-iumyl)-7-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate IUPAC Name: 7-(8-ethoxycarbonylimidazo[1,2-a]pyridin-4-ium-1-yl)-7-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-(8-carbethoxyimidazo[1,2-a]pyridin-4-ium-1-yl)-8-keto-7-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Formula: C18H17N3O5S MolecularWeight: 387.40968

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2N(C=C[N+]2=CC=C1)C3(C4N(C3=O)C(=CCS4)C(=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C2N(C=C[N+]2=CC=C1)C3(C4N(C3=O)C(=CCS4)C(=O)[O-])C

InChI

InChI=1S/C18H17N3O5S/c1-3-26-15(24)11-5-4-7-19-8-9-20(13(11)19)18(2)16(25)21-12(14(22)23)6-10-27-17(18)21/h4-9,17H,3,10H2,1-2H3