(4E)-6-methyl-7-oxidanylidene-4-(2-oxidanylidenepiperidin-3-ylidene)-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: (4E)-6-methyl-7-oxidanylidene-4-(2-oxidanylidenepiperidin-3-ylidene)-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: (4E)-6-methyl-7-oxo-4-(2-oxo-3-piperidylidene)-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: (4E)-6-methyl-7-oxo-4-(2-oxo-3-piperidinylidene)-6-(3-pyrrolidinylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: (4E)-6-methyl-7-oxo-4-(2-oxopiperidin-3-ylidene)-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: (4E)-7-keto-4-(2-keto-3-piperidylidene)-6-methyl-6-(pyrrolidin-3-ylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2C(=C3CCCNC3=O)C=C(N2C1=O)C(=O)O)SC4CCNC4

Isomeric SMILES

CC1(C2/C(=C/3\CCCNC3=O)/C=C(N2C1=O)C(=O)O)SC4CCNC4

InChI

InChI=1S/C17H21N3O4S/c1-17(25-9-4-6-18-8-9)13-11(10-3-2-5-19-14(10)21)7-12(15(22)23)20(13)16(17)24/h7,9,13,18H,2-6,8H2,1H3,(H,19,21)(H,22,23)/b11-10+