6-(1-methanoyloxyethyl)-3-[(E)-3-[(4-nitrophenyl)methoxy]-3-oxidanylidene-prop-1-enyl]sulfanyl-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: 6-(1-methanoyloxyethyl)-3-[(E)-3-[(4-nitrophenyl)methoxy]-3-oxidanylidene-prop-1-enyl]sulfanyl-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: 6-(1-formyloxyethyl)-3-[(E)-3-[(4-nitrophenyl)methoxy]-3-oxo-prop-1-enyl]sulfanyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 6-(1-formyloxyethyl)-3-[[(E)-3-[(4-nitrophenyl)methoxy]-3-oxoprop-1-enyl]thio]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: 6-(1-formyloxyethyl)-3-[(E)-3-[(4-nitrophenyl)methoxy]-3-oxoprop-1-enyl]sulfanyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 6-(1-formyloxyethyl)-7-keto-3-[[(E)-3-keto-3-(4-nitrobenzyl)oxy-prop-1-enyl]thio]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C20H17N2O9S- MolecularWeight: 461.42198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2CC(=C(N2C1=O)C(=O)[O-])SC=CC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])OC=O

Isomeric SMILES

CC(C1C2CC(=C(N2C1=O)C(=O)[O-])S/C=C/C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])OC=O

InChI

InChI=1S/C20H18N2O9S/c1-11(31-10-23)17-14-8-15(18(20(26)27)21(14)19(17)25)32-7-6-16(24)30-9-12-2-4-13(5-3-12)22(28)29/h2-7,10-11,14,17H,8-9H2,1H3,(H,26,27)/p-1/b7-6+