N-[3-(3-methylpyridin-1-ium-1-yl)-1,4-bis(oxidanylidene)naphthalen-2-yl]thiophene-2-sulfonamide

Systemtic Name: N-[3-(3-methylpyridin-1-ium-1-yl)-1,4-bis(oxidanylidene)naphthalen-2-yl]thiophene-2-sulfonamide Openeye Name: N-[3-(3-methylpyridin-1-ium-1-yl)-1,4-dioxo-2-naphthyl]thiophene-2-sulfonamide CAS Name: N-[3-(3-methyl-1-pyridin-1-iumyl)-1,4-dioxo-2-naphthalenyl]-2-thiophenesulfonamide IUPAC Name: N-[3-(3-methylpyridin-1-ium-1-yl)-1,4-dioxonaphthalen-2-yl]thiophene-2-sulfonamide Traditional Name: N-[1,4-diketo-3-(3-methylpyridin-1-ium-1-yl)-2-naphthyl]thiophene-2-sulfonamide Formula: C20H15N2O4S2+ MolecularWeight: 411.4741

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CC=C1)C2=C(C(=O)C3=CC=CC=C3C2=O)NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC1=C[N+](=CC=C1)C2=C(C(=O)C3=CC=CC=C3C2=O)NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C20H14N2O4S2/c1-13-6-4-10-22(12-13)18-17(21-28(25,26)16-9-5-11-27-16)19(23)14-7-2-3-8-15(14)20(18)24/h2-12H,1H3/p+1