[4-[5,7-bis(oxidanylidene)pyrrolo[3,4-b]pyridin-6-yl]-2-oxidanylidene-butyl]-dimethyl-sulfanium

Systemtic Name: [4-[5,7-bis(oxidanylidene)pyrrolo[3,4-b]pyridin-6-yl]-2-oxidanylidene-butyl]-dimethyl-sulfanium Openeye Name: [4-(5,7-dioxopyrrolo[3,4-b]pyridin-6-yl)-2-oxo-butyl]-dimethyl-sulfonium CAS Name: [4-(5,7-dioxo-6-pyrrolo[3,4-b]pyridinyl)-2-oxobutyl]-dimethylsulfonium IUPAC Name: [4-(5,7-dioxopyrrolo[3,4-b]pyridin-6-yl)-2-oxobutyl]-dimethylsulfanium Traditional Name: [4-(5,7-diketopyrrolo[3,4-b]pyridin-6-yl)-2-keto-butyl]-dimethyl-sulfonium Formula: C13H15N2O3S+ MolecularWeight: 279.3348

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Descriptors Computed from Structure

Canonical SMILES:

C[S+](C)CC(=O)CCN1C(=O)C2=C(C1=O)N=CC=C2

Isomeric SMILES

C[S+](C)CC(=O)CCN1C(=O)C2=C(C1=O)N=CC=C2

InChI

InChI=1S/C13H15N2O3S/c1-19(2)8-9(16)5-7-15-12(17)10-4-3-6-14-11(10)13(15)18/h3-4,6H,5,7-8H2,1-2H3/q+1