(1-ethyl-2,2-dimethyl-quinolin-4-yl)methanesulfonic acid

Systemtic Name: (1-ethyl-2,2-dimethyl-quinolin-4-yl)methanesulfonic acid Openeye Name: (1-ethyl-2,2-dimethyl-4-quinolyl)methanesulfonic acid CAS Name: (1-ethyl-2,2-dimethyl-4-quinolinyl)methanesulfonic acid IUPAC Name: (1-ethyl-2,2-dimethylquinolin-4-yl)methanesulfonic acid Traditional Name: (1-ethyl-2,2-dimethyl-4-quinolyl)methanesulfonic acid Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=CC1(C)C)CS(=O)(=O)O

Isomeric SMILES

CCN1C2=CC=CC=C2C(=CC1(C)C)CS(=O)(=O)O

InChI

InChI=1S/C14H19NO3S/c1-4-15-13-8-6-5-7-12(13)11(9-14(15,2)3)10-19(16,17)18/h5-9H,4,10H2,1-3H3,(H,16,17,18)