3-[methyl(methylsulfonyl)amino]-5-pentan-3-yloxy-benzoic acid

Systemtic Name: 3-[methyl(methylsulfonyl)amino]-5-pentan-3-yloxy-benzoic acid Openeye Name: 3-(1-ethylpropoxy)-5-[methyl(methylsulfonyl)amino]benzoic acid CAS Name: 3-[methyl(methylsulfonyl)amino]-5-pentan-3-yloxybenzoic acid IUPAC Name: 3-[methyl(methylsulfonyl)amino]-5-pentan-3-yloxybenzoic acid Traditional Name: 3-(1-ethylpropoxy)-5-[mesyl(methyl)amino]benzoic acid Formula: C14H21NO5S MolecularWeight: 315.38524

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC1=CC(=CC(=C1)N(C)S(=O)(=O)C)C(=O)O

Isomeric SMILES

CCC(CC)OC1=CC(=CC(=C1)N(C)S(=O)(=O)C)C(=O)O

InChI

InChI=1S/C14H21NO5S/c1-5-12(6-2)20-13-8-10(14(16)17)7-11(9-13)15(3)21(4,18)19/h7-9,12H,5-6H2,1-4H3,(H,16,17)