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

Systemtic Name: N-[1,4-bis(oxidanylidene)-3-[4-(3-phenylpropyl)pyridin-1-ium-1-yl]naphthalen-2-yl]thiophene-2-sulfonamide Openeye Name: N-[1,4-dioxo-3-[4-(3-phenylpropyl)pyridin-1-ium-1-yl]-2-naphthyl]thiophene-2-sulfonamide CAS Name: N-[1,4-dioxo-3-[4-(3-phenylpropyl)-1-pyridin-1-iumyl]-2-naphthalenyl]-2-thiophenesulfonamide IUPAC Name: N-[1,4-dioxo-3-[4-(3-phenylpropyl)pyridin-1-ium-1-yl]naphthalen-2-yl]thiophene-2-sulfonamide Traditional Name: N-[1,4-diketo-3-[4-(3-phenylpropyl)pyridin-1-ium-1-yl]-2-naphthyl]thiophene-2-sulfonamide Formula: C28H23N2O4S2+ MolecularWeight: 515.62322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC2=CC=[N+](C=C2)C3=C(C(=O)C4=CC=CC=C4C3=O)NS(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1=CC=C(C=C1)CCCC2=CC=[N+](C=C2)C3=C(C(=O)C4=CC=CC=C4C3=O)NS(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C28H22N2O4S2/c31-27-22-12-4-5-13-23(22)28(32)26(25(27)29-36(33,34)24-14-7-19-35-24)30-17-15-21(16-18-30)11-6-10-20-8-2-1-3-9-20/h1-5,7-9,12-19H,6,10-11H2/p+1