3-(2,3-dihydro-1H-inden-2-ylsulfanyl)-6-(1-hydroxyethyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: 3-(2,3-dihydro-1H-inden-2-ylsulfanyl)-6-(1-hydroxyethyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: 6-(1-hydroxyethyl)-3-indan-2-ylsulfanyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 3-(2,3-dihydro-1H-inden-2-ylthio)-6-(1-hydroxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: 3-(2,3-dihydro-1H-inden-2-ylsulfanyl)-6-(1-hydroxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 6-(1-hydroxyethyl)-3-(indan-2-ylthio)-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C17H16NO4S2- MolecularWeight: 362.44324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2N(C1=O)C(=C(S2)SC3CC4=CC=CC=C4C3)C(=O)[O-])O

Isomeric SMILES

CC(C1C2N(C1=O)C(=C(S2)SC3CC4=CC=CC=C4C3)C(=O)[O-])O

InChI

InChI=1S/C17H17NO4S2/c1-8(19)12-14(20)18-13(16(21)22)17(24-15(12)18)23-11-6-9-4-2-3-5-10(9)7-11/h2-5,8,11-12,15,19H,6-7H2,1H3,(H,21,22)/p-1