ethyl cyclohexene-1-carboxylate; 1-(sulfinoamino)-2-(trifluoromethyl)benzene

Systemtic Name: ethyl cyclohexene-1-carboxylate; 1-(sulfinoamino)-2-(trifluoromethyl)benzene Openeye Name: ethyl cyclohexene-1-carboxylate; 1-(sulfinoamino)-2-(trifluoromethyl)benzene CAS Name: 1-cyclohexenecarboxylic acid ethyl ester; 1-(sulfinoamino)-2-(trifluoromethyl)benzene IUPAC Name: ethyl cyclohexene-1-carboxylate; 1-(sulfinoamino)-2-(trifluoromethyl)benzene Traditional Name: cyclohexene-1-carboxylic acid ethyl ester; 1-(sulfinoamino)-2-(trifluoromethyl)benzene Formula: C16H20F3NO4S MolecularWeight: 379.39451

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CCCCC1.C1=CC=C(C(=C1)C(F)(F)F)NS(=O)O

Isomeric SMILES

CCOC(=O)C1=CCCCC1.C1=CC=C(C(=C1)C(F)(F)F)NS(=O)O

InChI

InChI=1S/C9H14O2.C7H6F3NO2S/c1-2-11-9(10)8-6-4-3-5-7-8;8-7(9,10)5-3-1-2-4-6(5)11-14(12)13/h6H,2-5,7H2,1H3;1-4,11H,(H,12,13)