(1S,6S)-6-[2-(2,4-dichlorophenyl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: (1S,6S)-6-[2-(2,4-dichlorophenyl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1S,6S)-6-[2-(2,4-dichlorophenyl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1S,6S)-6-[[2-(2,4-dichlorophenyl)ethylamino]-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6S)-6-[2-(2,4-dichlorophenyl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6S)-6-[2-(2,4-dichlorophenyl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylate Formula: C16H16Cl2NO3- MolecularWeight: 341.20914

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C(=O)NCCC2=C(C=C(C=C2)Cl)Cl)C(=O)[O-]

Isomeric SMILES

C1C=CC[C@@H]([C@H]1C(=O)NCCC2=C(C=C(C=C2)Cl)Cl)C(=O)[O-]

InChI

InChI=1S/C16H17Cl2NO3/c17-11-6-5-10(14(18)9-11)7-8-19-15(20)12-3-1-2-4-13(12)16(21)22/h1-2,5-6,9,12-13H,3-4,7-8H2,(H,19,20)(H,21,22)/p-1/t12-,13-/m0/s1