pyrrolidin-3-yl 7-oxidanylidene-3-[oxidanyl(pyrrolidin-3-yl)methyl]-6-sulfanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: pyrrolidin-3-yl 7-oxidanylidene-3-[oxidanyl(pyrrolidin-3-yl)methyl]-6-sulfanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: pyrrolidin-3-yl 3-[hydroxy(pyrrolidin-3-yl)methyl]-7-oxo-6-thioxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 3-[hydroxy(3-pyrrolidinyl)methyl]-7-oxo-6-sulfanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid 3-pyrrolidinyl ester IUPAC Name: pyrrolidin-3-yl 3-[hydroxy(pyrrolidin-3-yl)methyl]-7-oxo-6-sulfanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 3-[hydroxy(pyrrolidin-3-yl)methyl]-7-keto-6-thioxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid pyrrolidin-3-yl ester Formula: C16H21N3O4S MolecularWeight: 351.42064

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC1C(C2=C(N3C(C2)C(=S)C3=O)C(=O)OC4CCNC4)O

Isomeric SMILES

C1CNCC1C(C2=C(N3C(C2)C(=S)C3=O)C(=O)OC4CCNC4)O

InChI

InChI=1S/C16H21N3O4S/c20-13(8-1-3-17-6-8)10-5-11-14(24)15(21)19(11)12(10)16(22)23-9-2-4-18-7-9/h8-9,11,13,17-18,20H,1-7H2