6-[5-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]sulfanyl-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 6-[5-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]sulfanyl-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 6-[5-(1-methyl-4-piperidyl)pyrrolidin-3-yl]sulfanyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 6-[[5-(1-methyl-4-piperidinyl)-3-pyrrolidinyl]thio]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 6-[5-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]sulfanyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 7-keto-6-[[5-(1-methyl-4-piperidyl)pyrrolidin-3-yl]thio]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C17H25N3O3S MolecularWeight: 351.4637

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)C2CC(CN2)SC3C4CC=C(N4C3=O)C(=O)O

Isomeric SMILES

CN1CCC(CC1)C2CC(CN2)SC3C4CC=C(N4C3=O)C(=O)O

InChI

InChI=1S/C17H25N3O3S/c1-19-6-4-10(5-7-19)12-8-11(9-18-12)24-15-13-2-3-14(17(22)23)20(13)16(15)21/h3,10-13,15,18H,2,4-9H2,1H3,(H,22,23)