7-oxidanylidene-6-[(E)-3-pyrrolidin-1-ylprop-1-enyl]-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 7-oxidanylidene-6-[(E)-3-pyrrolidin-1-ylprop-1-enyl]-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 7-oxo-6-[(E)-3-pyrrolidin-1-ylprop-1-enyl]-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 7-oxo-6-[(E)-3-(1-pyrrolidinyl)prop-1-enyl]-6-(3-pyrrolidinylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 7-oxo-6-[(E)-3-pyrrolidin-1-ylprop-1-enyl]-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 7-keto-6-[(E)-3-pyrrolidinoprop-1-enyl]-6-(pyrrolidin-3-ylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C18H25N3O3S MolecularWeight: 363.4744

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC=CC2(C3CC=C(N3C2=O)C(=O)O)SC4CCNC4

Isomeric SMILES

C1CCN(C1)C/C=C/C2(C3CC=C(N3C2=O)C(=O)O)SC4CCNC4

InChI

InChI=1S/C18H25N3O3S/c22-16(23)14-4-5-15-18(17(24)21(14)15,25-13-6-8-19-12-13)7-3-11-20-9-1-2-10-20/h3-4,7,13,15,19H,1-2,5-6,8-12H2,(H,22,23)/b7-3+