N-(3,4-dihydro-2H-pyrrol-1-ium-5-yl)-3-[(5-ethoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]benzenesulfonamide

Systemtic Name: N-(3,4-dihydro-2H-pyrrol-1-ium-5-yl)-3-[(5-ethoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]benzenesulfonamide Openeye Name: N-(3,4-dihydro-2H-pyrrol-1-ium-5-yl)-3-[(5-ethoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]benzenesulfonamide CAS Name: N-(3,4-dihydro-2H-pyrrol-1-ium-5-yl)-3-[(5-ethoxy-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]benzenesulfonamide IUPAC Name: N-(3,4-dihydro-2H-pyrrol-1-ium-5-yl)-3-[(5-ethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]benzenesulfonamide Traditional Name: 3-[(5-ethoxy-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]-N-(1-pyrrolin-1-ium-2-yl)benzenesulfonamide Formula: C19H22N3O4S+ MolecularWeight: 388.46068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=CNC2=CC(=CC=C2)S(=O)(=O)NC3=[NH+]CCC3)C1=O

Isomeric SMILES

CCOC1=CC=CC(=CNC2=CC(=CC=C2)S(=O)(=O)NC3=[NH+]CCC3)C1=O

InChI

InChI=1S/C19H21N3O4S/c1-2-26-17-9-3-6-14(19(17)23)13-21-15-7-4-8-16(12-15)27(24,25)22-18-10-5-11-20-18/h3-4,6-9,12-13,21H,2,5,10-11H2,1H3,(H,20,22)/p+1