2,3,3-tris(chloranyl)prop-2-enyl 6-[(4-methylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: 2,3,3-tris(chloranyl)prop-2-enyl 6-[(4-methylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: 2,3,3-trichloroallyl 6-(p-tolylcarbamoyl)cyclohex-3-ene-1-carboxylate CAS Name: 6-[(4-methylanilino)-oxomethyl]-1-cyclohex-3-enecarboxylic acid 2,3,3-trichloroprop-2-enyl ester IUPAC Name: 2,3,3-trichloroprop-2-enyl 6-[(4-methylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: 6-(p-tolylcarbamoyl)cyclohex-3-ene-1-carboxylic acid 2,3,3-trichloroallyl ester Formula: C18H18Cl3NO3 MolecularWeight: 402.69942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2CC=CCC2C(=O)OCC(=C(Cl)Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2CC=CCC2C(=O)OCC(=C(Cl)Cl)Cl

InChI

InChI=1S/C18H18Cl3NO3/c1-11-6-8-12(9-7-11)22-17(23)13-4-2-3-5-14(13)18(24)25-10-15(19)16(20)21/h2-3,6-9,13-14H,4-5,10H2,1H3,(H,22,23)