3-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]sulfanyl-6-(1-hydroxyethyl)-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: 3-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]sulfanyl-6-(1-hydroxyethyl)-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: 3-[(E)-3-ethoxy-3-oxo-prop-1-enyl]sulfanyl-6-(1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 3-[[(E)-3-ethoxy-3-oxoprop-1-enyl]thio]-6-(1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: 3-[(E)-3-ethoxy-3-oxoprop-1-enyl]sulfanyl-6-(1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 3-[[(E)-3-ethoxy-3-keto-prop-1-enyl]thio]-6-(1-hydroxyethyl)-7-keto-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C14H16NO6S- MolecularWeight: 326.34494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CSC1=C(N2C(C1)C(C2=O)C(C)O)C(=O)[O-]

Isomeric SMILES

CCOC(=O)/C=C/SC1=C(N2C(C1)C(C2=O)C(C)O)C(=O)[O-]

InChI

InChI=1S/C14H17NO6S/c1-3-21-10(17)4-5-22-9-6-8-11(7(2)16)13(18)15(8)12(9)14(19)20/h4-5,7-8,11,16H,3,6H2,1-2H3,(H,19,20)/p-1/b5-4+