N-[2-[(3-cyano-7-methoxy-quinolin-1-ium-2-yl)amino]ethyl]benzenesulfonamide

Systemtic Name: N-[2-[(3-cyano-7-methoxy-quinolin-1-ium-2-yl)amino]ethyl]benzenesulfonamide Openeye Name: N-[2-[(3-cyano-7-methoxy-quinolin-1-ium-2-yl)amino]ethyl]benzenesulfonamide CAS Name: N-[2-[(3-cyano-7-methoxy-2-quinolin-1-iumyl)amino]ethyl]benzenesulfonamide IUPAC Name: N-[2-[(3-cyano-7-methoxyquinolin-1-ium-2-yl)amino]ethyl]benzenesulfonamide Traditional Name: N-[2-[(3-cyano-7-methoxy-quinolin-1-ium-2-yl)amino]ethyl]benzenesulfonamide Formula: C19H19N4O3S+ MolecularWeight: 383.44416

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=[NH+]2)NCCNS(=O)(=O)C3=CC=CC=C3)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=[NH+]2)NCCNS(=O)(=O)C3=CC=CC=C3)C#N

InChI

InChI=1S/C19H18N4O3S/c1-26-16-8-7-14-11-15(13-20)19(23-18(14)12-16)21-9-10-22-27(24,25)17-5-3-2-4-6-17/h2-8,11-12,22H,9-10H2,1H3,(H,21,23)/p+1