3-(7-methoxy-2,2,4-trimethyl-quinolin-1-yl)propane-1-sulfonic acid

Systemtic Name: 3-(7-methoxy-2,2,4-trimethyl-quinolin-1-yl)propane-1-sulfonic acid Openeye Name: 3-(7-methoxy-2,2,4-trimethyl-1-quinolyl)propane-1-sulfonic acid CAS Name: 3-(7-methoxy-2,2,4-trimethyl-1-quinolinyl)-1-propanesulfonic acid IUPAC Name: 3-(7-methoxy-2,2,4-trimethylquinolin-1-yl)propane-1-sulfonic acid Traditional Name: 3-(7-methoxy-2,2,4-trimethyl-1-quinolyl)propane-1-sulfonic acid Formula: C16H23NO4S MolecularWeight: 325.42312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N(C2=C1C=CC(=C2)OC)CCCS(=O)(=O)O)(C)C

Isomeric SMILES

CC1=CC(N(C2=C1C=CC(=C2)OC)CCCS(=O)(=O)O)(C)C

InChI

InChI=1S/C16H23NO4S/c1-12-11-16(2,3)17(8-5-9-22(18,19)20)15-10-13(21-4)6-7-14(12)15/h6-7,10-11H,5,8-9H2,1-4H3,(H,18,19,20)