sodium 3,3-dimethyl-6-[2-[methyl(phenyl)amino]-1-oxidanyl-2-oxidanylidene-ethyl]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: sodium 3,3-dimethyl-6-[2-[methyl(phenyl)amino]-1-oxidanyl-2-oxidanylidene-ethyl]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: sodium 6-[1-hydroxy-2-(N-methylanilino)-2-oxo-ethyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: sodium 6-[1-hydroxy-2-(N-methylanilino)-2-oxoethyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate IUPAC Name: sodium 6-[1-hydroxy-2-(N-methylanilino)-2-oxoethyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: sodium 6-[1-hydroxy-2-keto-2-(N-methylanilino)ethyl]-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Formula: C17H19N2NaO5S MolecularWeight: 386.39793

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)C(C(=O)N(C)C3=CC=CC=C3)O)C(=O)[O-])C.[Na+]

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)C(C(=O)N(C)C3=CC=CC=C3)O)C(=O)[O-])C.[Na+]

InChI

InChI=1S/C17H20N2O5S.Na/c1-17(2)12(16(23)24)19-13(21)10(15(19)25-17)11(20)14(22)18(3)9-7-5-4-6-8-9;/h4-8,10-12,15,20H,1-3H3,(H,23,24);/q;+1/p-1