N-(3,4-dihydro-2H-pyrrol-1-ium-5-yl)-3-[(2-oxidanylidenenaphthalen-1-ylidene)methylamino]benzenesulfonamide

Systemtic Name: N-(3,4-dihydro-2H-pyrrol-1-ium-5-yl)-3-[(2-oxidanylidenenaphthalen-1-ylidene)methylamino]benzenesulfonamide Openeye Name: N-(3,4-dihydro-2H-pyrrol-1-ium-5-yl)-3-[(2-oxo-1-naphthylidene)methylamino]benzenesulfonamide CAS Name: N-(3,4-dihydro-2H-pyrrol-1-ium-5-yl)-3-[(2-oxo-1-naphthalenylidene)methylamino]benzenesulfonamide IUPAC Name: N-(3,4-dihydro-2H-pyrrol-1-ium-5-yl)-3-[(2-oxonaphthalen-1-ylidene)methylamino]benzenesulfonamide Traditional Name: 3-[(2-keto-1-naphthylidene)methylamino]-N-(1-pyrrolin-1-ium-2-yl)benzenesulfonamide Formula: C21H20N3O3S+ MolecularWeight: 394.4668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=CC(=C2)NC=C3C(=O)C=CC4=CC=CC=C43

Isomeric SMILES

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=CC(=C2)NC=C3C(=O)C=CC4=CC=CC=C43

InChI

InChI=1S/C21H19N3O3S/c25-20-11-10-15-5-1-2-8-18(15)19(20)14-23-16-6-3-7-17(13-16)28(26,27)24-21-9-4-12-22-21/h1-3,5-8,10-11,13-14,23H,4,9,12H2,(H,22,24)/p+1