[(E)-3-(8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl)prop-2-enyl]azanium

Systemtic Name: [(E)-3-(8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl)prop-2-enyl]azanium Openeye Name: [(E)-3-(8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl)allyl]ammonium CAS Name: [(E)-3-(8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl)prop-2-enyl]ammonium IUPAC Name: [(E)-3-(8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl)prop-2-enyl]azanium Traditional Name: [(E)-3-(8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl)allyl]ammonium Formula: C9H13N2OS+ MolecularWeight: 197.27732

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CN2C(S1)C(C2=O)C=CC[NH3+]

Isomeric SMILES

C1C=CN2C(S1)C(C2=O)/C=C/C[NH3+]

InChI

InChI=1S/C9H12N2OS/c10-4-1-3-7-8(12)11-5-2-6-13-9(7)11/h1-3,5,7,9H,4,6,10H2/p+1/b3-1+