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

Systemtic Name: 4-(7-methoxy-2,2,4-trimethyl-quinolin-1-yl)butane-1-sulfonic acid Openeye Name: 4-(7-methoxy-2,2,4-trimethyl-1-quinolyl)butane-1-sulfonic acid CAS Name: 4-(7-methoxy-2,2,4-trimethyl-1-quinolinyl)-1-butanesulfonic acid IUPAC Name: 4-(7-methoxy-2,2,4-trimethylquinolin-1-yl)butane-1-sulfonic acid Traditional Name: 4-(7-methoxy-2,2,4-trimethyl-1-quinolyl)butane-1-sulfonic acid Formula: C17H25NO4S MolecularWeight: 339.4497

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25NO4S/c1-13-12-17(2,3)18(9-5-6-10-23(19,20)21)16-11-14(22-4)7-8-15(13)16/h7-8,11-12H,5-6,9-10H2,1-4H3,(H,19,20,21)