(5R,6S)-3-[[(2S)-2-carboxypyrrolidin-1-yl]methyl]-6-[(1R)-1-oxidanylethyl]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: (5R,6S)-3-[[(2S)-2-carboxypyrrolidin-1-yl]methyl]-6-[(1R)-1-oxidanylethyl]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: (5R,6S)-3-[[(2S)-2-carboxypyrrolidin-1-yl]methyl]-6-[(1R)-1-hydroxyethyl]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: (5R,6S)-3-[[(2S)-2-carboxy-1-pyrrolidinyl]methyl]-6-[(1R)-1-hydroxyethyl]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: (5R,6S)-3-[[(2S)-2-carboxypyrrolidin-1-yl]methyl]-6-[(1R)-1-hydroxyethyl]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: (5R,6S)-3-[[(2S)-2-carboxypyrrolidino]methyl]-6-[(1R)-1-hydroxyethyl]-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C14H18N2O6S MolecularWeight: 342.36752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2N(C1=O)C(=C(S2)CN3CCCC3C(=O)O)C(=O)O)O

Isomeric SMILES

C[C@H]([C@@H]1[C@@H]2N(C1=O)C(=C(S2)CN3CCC[C@H]3C(=O)O)C(=O)O)O

InChI

InChI=1S/C14H18N2O6S/c1-6(17)9-11(18)16-10(14(21)22)8(23-12(9)16)5-15-4-2-3-7(15)13(19)20/h6-7,9,12,17H,2-5H2,1H3,(H,19,20)(H,21,22)/t6-,7+,9+,12-/m1/s1