6-methyl-N-(phenylmethyl)-3-(phenylsulfonyl)quinolin-1-ium-4-amine

Systemtic Name: 6-methyl-N-(phenylmethyl)-3-(phenylsulfonyl)quinolin-1-ium-4-amine Openeye Name: 3-(benzenesulfonyl)-N-benzyl-6-methyl-quinolin-1-ium-4-amine CAS Name: 3-(benzenesulfonyl)-6-methyl-N-(phenylmethyl)-4-quinolin-1-iumamine IUPAC Name: 3-(benzenesulfonyl)-N-benzyl-6-methylquinolin-1-ium-4-amine Traditional Name: benzyl-(3-besyl-6-methyl-quinolin-1-ium-4-yl)amine Formula: C23H21N2O2S+ MolecularWeight: 389.49004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C[NH+]=C2C=C1)S(=O)(=O)C3=CC=CC=C3)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C(=C[NH+]=C2C=C1)S(=O)(=O)C3=CC=CC=C3)NCC4=CC=CC=C4

InChI

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