hydroxymethyl-dimethyl-[2-(4-methyl-7-oxidanylidene-2-pyrrolidin-3-ylsulfanyloxycarbonyl-1-azabicyclo[3.2.0]hept-2-en-6-yl)ethyl]azanium

Systemtic Name: hydroxymethyl-dimethyl-[2-(4-methyl-7-oxidanylidene-2-pyrrolidin-3-ylsulfanyloxycarbonyl-1-azabicyclo[3.2.0]hept-2-en-6-yl)ethyl]azanium Openeye Name: hydroxymethyl-dimethyl-[2-(4-methyl-7-oxo-2-pyrrolidin-3-ylsulfanyloxycarbonyl-1-azabicyclo[3.2.0]hept-2-en-6-yl)ethyl]ammonium CAS Name: hydroxymethyl-dimethyl-[2-[4-methyl-7-oxo-2-[oxo-(3-pyrrolidinylthio)oxymethyl]-1-azabicyclo[3.2.0]hept-2-en-6-yl]ethyl]ammonium IUPAC Name: hydroxymethyl-dimethyl-[2-(4-methyl-7-oxo-2-pyrrolidin-3-ylsulfanyloxycarbonyl-1-azabicyclo[3.2.0]hept-2-en-6-yl)ethyl]azanium Traditional Name: 2-[7-keto-4-methyl-2-(pyrrolidin-3-ylthio)oxycarbonyl-1-azabicyclo[3.2.0]hept-2-en-6-yl]ethyl-dimethyl-methylol-ammonium Formula: C17H28N3O4S+ MolecularWeight: 370.48692

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=C(N2C1C(C2=O)CC[N+](C)(C)CO)C(=O)OSC3CCNC3

Isomeric SMILES

CC1C=C(N2C1C(C2=O)CC[N+](C)(C)CO)C(=O)OSC3CCNC3

InChI

InChI=1S/C17H28N3O4S/c1-11-8-14(17(23)24-25-12-4-6-18-9-12)19-15(11)13(16(19)22)5-7-20(2,3)10-21/h8,11-13,15,18,21H,4-7,9-10H2,1-3H3/q+1