sodium (5S,6S)-7-oxidanylidene-6-propan-2-yl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: sodium (5S,6S)-7-oxidanylidene-6-propan-2-yl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: sodium (5S,6S)-6-isopropyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: sodium (5S,6S)-7-oxo-6-propan-2-yl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: sodium (5S,6S)-7-oxo-6-propan-2-yl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: sodium (5S,6S)-6-isopropyl-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C9H10NNaO3S MolecularWeight: 235.23537

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C2N(C1=O)C(=CS2)C(=O)[O-].[Na+]

Isomeric SMILES

CC(C)[C@@H]1[C@H]2N(C1=O)C(=CS2)C(=O)[O-].[Na+]

InChI

InChI=1S/C9H11NO3S.Na/c1-4(2)6-7(11)10-5(9(12)13)3-14-8(6)10;/h3-4,6,8H,1-2H3,(H,12,13);/q;+1/p-1/t6-,8-;/m0./s1