(2-chloranyl-4-methylsulfanyl-phenyl)methyl 3-[(E)-3-butoxy-3-oxidanylidene-prop-1-enyl]-2,2-dimethyl-cyclopropane-1-carboxylate

Systemtic Name: (2-chloranyl-4-methylsulfanyl-phenyl)methyl 3-[(E)-3-butoxy-3-oxidanylidene-prop-1-enyl]-2,2-dimethyl-cyclopropane-1-carboxylate Openeye Name: (2-chloro-4-methylsulfanyl-phenyl)methyl 3-[(E)-3-butoxy-3-oxo-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylate CAS Name: 3-[(E)-3-butoxy-3-oxoprop-1-enyl]-2,2-dimethyl-1-cyclopropanecarboxylic acid [2-chloro-4-(methylthio)phenyl]methyl ester IUPAC Name: (2-chloro-4-methylsulfanylphenyl)methyl 3-[(E)-3-butoxy-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate Traditional Name: 3-[(E)-3-butoxy-3-keto-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylic acid [2-chloro-4-(methylthio)benzyl] ester Formula: C21H27ClO4S MolecularWeight: 410.95468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C=CC1C(C1(C)C)C(=O)OCC2=C(C=C(C=C2)SC)Cl

Isomeric SMILES

CCCCOC(=O)/C=C/C1C(C1(C)C)C(=O)OCC2=C(C=C(C=C2)SC)Cl

InChI

InChI=1S/C21H27ClO4S/c1-5-6-11-25-18(23)10-9-16-19(21(16,2)3)20(24)26-13-14-7-8-15(27-4)12-17(14)22/h7-10,12,16,19H,5-6,11,13H2,1-4H3/b10-9+