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

Systemtic Name: N,N-diethyl-6-methyl-3-(phenylsulfonyl)quinolin-1-ium-4-amine Openeye Name: 3-(benzenesulfonyl)-N,N-diethyl-6-methyl-quinolin-1-ium-4-amine CAS Name: 3-(benzenesulfonyl)-N,N-diethyl-6-methyl-4-quinolin-1-iumamine IUPAC Name: 3-(benzenesulfonyl)-N,N-diethyl-6-methylquinolin-1-ium-4-amine Traditional Name: (3-besyl-6-methyl-quinolin-1-ium-4-yl)-diethyl-amine Formula: C20H23N2O2S+ MolecularWeight: 355.47382

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C2C=C(C=CC2=[NH+]C=C1S(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CCN(CC)C1=C2C=C(C=CC2=[NH+]C=C1S(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C20H22N2O2S/c1-4-22(5-2)20-17-13-15(3)11-12-18(17)21-14-19(20)25(23,24)16-9-7-6-8-10-16/h6-14H,4-5H2,1-3H3/p+1