methyl 2-oxidanylidene-9,9a-dihydro-3H-indeno[1,2-e][1,3,4]thiadiazin-2-ium-7-carboxylate

Systemtic Name: methyl 2-oxidanylidene-9,9a-dihydro-3H-indeno[1,2-e][1,3,4]thiadiazin-2-ium-7-carboxylate Openeye Name: methyl 2-oxo-9,9a-dihydro-3H-indeno[1,2-e][1,3,4]thiadiazin-2-ium-7-carboxylate CAS Name: 2-oxo-9,9a-dihydro-3H-indeno[1,2-e][1,3,4]thiadiazin-2-ium-7-carboxylic acid methyl ester IUPAC Name: methyl 2-oxo-9,9a-dihydro-3H-indeno[1,2-e][1,3,4]thiadiazin-2-ium-7-carboxylate Traditional Name: 2-keto-9,9a-dihydro-3H-indeno[1,2-e][1,3,4]thiadiazin-2-ium-7-carboxylic acid methyl ester Formula: C12H11N2O3S+ MolecularWeight: 263.29234

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CCC2C(=C1)C=C3C2=N[N+](=O)CS3

Isomeric SMILES

COC(=O)C1=CCC2C(=C1)C=C3C2=N[N+](=O)CS3

InChI

InChI=1S/C12H11N2O3S/c1-17-12(15)7-2-3-9-8(4-7)5-10-11(9)13-14(16)6-18-10/h2,4-5,9H,3,6H2,1H3/q+1