3-(4-methylphenyl)sulfonyl-N-(phenylmethyl)quinolin-1-ium-4-amine

Systemtic Name: 3-(4-methylphenyl)sulfonyl-N-(phenylmethyl)quinolin-1-ium-4-amine Openeye Name: N-benzyl-3-(p-tolylsulfonyl)quinolin-1-ium-4-amine CAS Name: 3-(4-methylphenyl)sulfonyl-N-(phenylmethyl)-4-quinolin-1-iumamine IUPAC Name: N-benzyl-3-(4-methylphenyl)sulfonylquinolin-1-ium-4-amine Traditional Name: benzyl-(3-tosylquinolin-1-ium-4-yl)amine Formula: C23H21N2O2S+ MolecularWeight: 389.49004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C3=CC=CC=C3[NH+]=C2)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C3=CC=CC=C3[NH+]=C2)NCC4=CC=CC=C4

InChI

InChI=1S/C23H20N2O2S/c1-17-11-13-19(14-12-17)28(26,27)22-16-24-21-10-6-5-9-20(21)23(22)25-15-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3,(H,24,25)/p+1