6-(2,2-dimethyl-5-oxidanylidene-4-phenyl-imidazolidin-1-yl)-3-methyl-7-oxidanylidene-4-thia-1-azoniabicyclo[3.2.0]hept-2-ene-1-carboxylic acid

Systemtic Name: 6-(2,2-dimethyl-5-oxidanylidene-4-phenyl-imidazolidin-1-yl)-3-methyl-7-oxidanylidene-4-thia-1-azoniabicyclo[3.2.0]hept-2-ene-1-carboxylic acid Openeye Name: 6-(2,2-dimethyl-5-oxo-4-phenyl-imidazolidin-1-yl)-3-methyl-7-oxo-4-thia-1-azoniabicyclo[3.2.0]hept-2-ene-1-carboxylic acid CAS Name: 6-(2,2-dimethyl-5-oxo-4-phenyl-1-imidazolidinyl)-3-methyl-7-oxo-4-thia-1-azoniabicyclo[3.2.0]hept-2-ene-1-carboxylic acid IUPAC Name: 6-(2,2-dimethyl-5-oxo-4-phenylimidazolidin-1-yl)-3-methyl-7-oxo-4-thia-1-azoniabicyclo[3.2.0]hept-2-ene-1-carboxylic acid Traditional Name: 7-keto-6-(5-keto-2,2-dimethyl-4-phenyl-imidazolidin-1-yl)-3-methyl-4-thia-1-azoniabicyclo[3.2.0]hept-2-ene-1-carboxylic acid Formula: C18H20N3O4S+ MolecularWeight: 374.4341

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2(C(S1)C(C2=O)N3C(=O)C(NC3(C)C)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC1=C[N+]2(C(S1)C(C2=O)N3C(=O)C(NC3(C)C)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C18H19N3O4S/c1-10-9-21(17(24)25)15(23)13(16(21)26-10)20-14(22)12(19-18(20,2)3)11-7-5-4-6-8-11/h4-9,12-13,16,19H,1-3H3/p+1