3-(6-methyl-2-phenoxy-quinolin-1-ium-1-yl)propane-1-sulfonic acid

Systemtic Name: 3-(6-methyl-2-phenoxy-quinolin-1-ium-1-yl)propane-1-sulfonic acid Openeye Name: 3-(6-methyl-2-phenoxy-quinolin-1-ium-1-yl)propane-1-sulfonic acid CAS Name: 3-(6-methyl-2-phenoxy-1-quinolin-1-iumyl)-1-propanesulfonic acid IUPAC Name: 3-(6-methyl-2-phenoxyquinolin-1-ium-1-yl)propane-1-sulfonic acid Traditional Name: 3-(6-methyl-2-phenoxy-quinolin-1-ium-1-yl)propane-1-sulfonic acid Formula: C19H20NO4S+ MolecularWeight: 358.4314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)[N+](=C(C=C2)OC3=CC=CC=C3)CCCS(=O)(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)[N+](=C(C=C2)OC3=CC=CC=C3)CCCS(=O)(=O)O

InChI

InChI=1S/C19H19NO4S/c1-15-8-10-18-16(14-15)9-11-19(24-17-6-3-2-4-7-17)20(18)12-5-13-25(21,22)23/h2-4,6-11,14H,5,12-13H2,1H3/p+1