[3-ethyl-2-(2-methoxyphenoxy)-1-methyl-1-(phenylsulfonyl)-3,4-dihydroquinolin-1-ium-2-yl]methanamine

Systemtic Name: [3-ethyl-2-(2-methoxyphenoxy)-1-methyl-1-(phenylsulfonyl)-3,4-dihydroquinolin-1-ium-2-yl]methanamine Openeye Name: [1-(benzenesulfonyl)-3-ethyl-2-(2-methoxyphenoxy)-1-methyl-3,4-dihydroquinolin-1-ium-2-yl]methanamine CAS Name: [1-(benzenesulfonyl)-3-ethyl-2-(2-methoxyphenoxy)-1-methyl-3,4-dihydroquinolin-1-ium-2-yl]methanamine IUPAC Name: [1-(benzenesulfonyl)-3-ethyl-2-(2-methoxyphenoxy)-1-methyl-3,4-dihydroquinolin-1-ium-2-yl]methanamine Traditional Name: [1-besyl-3-ethyl-2-(2-methoxyphenoxy)-1-methyl-3,4-dihydroquinolin-1-ium-2-yl]methylamine Formula: C26H31N2O4S+ MolecularWeight: 467.60034

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC2=CC=CC=C2[N+](C1(CN)OC3=CC=CC=C3OC)(C)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCC1CC2=CC=CC=C2[N+](C1(CN)OC3=CC=CC=C3OC)(C)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H31N2O4S/c1-4-21-18-20-12-8-9-15-23(20)28(2,33(29,30)22-13-6-5-7-14-22)26(21,19-27)32-25-17-11-10-16-24(25)31-3/h5-17,21H,4,18-19,27H2,1-3H3/q+1