1-carboxy-5-(2-methylbutan-2-yl)-3-(sulfinatoamino)-2-[4-(trifluoromethyl)phenoxy]benzene

Systemtic Name: 1-carboxy-5-(2-methylbutan-2-yl)-3-(sulfinatoamino)-2-[4-(trifluoromethyl)phenoxy]benzene Openeye Name: 1-carboxy-5-(1,1-dimethylpropyl)-3-(sulfinatoamino)-2-[4-(trifluoromethyl)phenoxy]benzene CAS Name: 1-carboxy-5-(2-methylbutan-2-yl)-3-(sulfinatoamino)-2-[4-(trifluoromethyl)phenoxy]benzene IUPAC Name: 1-carboxy-5-(2-methylbutan-2-yl)-3-(sulfinatoamino)-2-[4-(trifluoromethyl)phenoxy]benzene Traditional Name: 5-tert-amyl-1-carboxy-3-(sulfinatoamino)-2-[4-(trifluoromethyl)phenoxy]benzene Formula: C19H19F3NO5S- MolecularWeight: 430.41807

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C(=C1)C(=O)O)OC2=CC=C(C=C2)C(F)(F)F)NS(=O)[O-]

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C(=C1)C(=O)O)OC2=CC=C(C=C2)C(F)(F)F)NS(=O)[O-]

InChI

InChI=1S/C19H20F3NO5S/c1-4-18(2,3)12-9-14(17(24)25)16(15(10-12)23-29(26)27)28-13-7-5-11(6-8-13)19(20,21)22/h5-10,23H,4H2,1-3H3,(H,24,25)(H,26,27)/p-1