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

Systemtic Name: N-[3-(3,4-dimethylpyridin-1-ium-1-yl)-1,4-bis(oxidanylidene)naphthalen-2-yl]thiophene-2-sulfonamide Openeye Name: N-[3-(3,4-dimethylpyridin-1-ium-1-yl)-1,4-dioxo-2-naphthyl]thiophene-2-sulfonamide CAS Name: N-[3-(3,4-dimethyl-1-pyridin-1-iumyl)-1,4-dioxo-2-naphthalenyl]-2-thiophenesulfonamide IUPAC Name: N-[3-(3,4-dimethylpyridin-1-ium-1-yl)-1,4-dioxonaphthalen-2-yl]thiophene-2-sulfonamide Traditional Name: N-[3-(3,4-dimethylpyridin-1-ium-1-yl)-1,4-diketo-2-naphthyl]thiophene-2-sulfonamide Formula: C21H17N2O4S2+ MolecularWeight: 425.50068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16N2O4S2/c1-13-9-10-23(12-14(13)2)19-18(22-29(26,27)17-8-5-11-28-17)20(24)15-6-3-4-7-16(15)21(19)25/h3-12H,1-2H3/p+1