(1S,6R)-6-[(3,4-dichlorophenyl)carbamoyl]-4-methyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: (1S,6R)-6-[(3,4-dichlorophenyl)carbamoyl]-4-methyl-cyclohex-3-ene-1-carboxylate Openeye Name: (1S,6R)-6-[(3,4-dichlorophenyl)carbamoyl]-4-methyl-cyclohex-3-ene-1-carboxylate CAS Name: (1S,6R)-6-[(3,4-dichloroanilino)-oxomethyl]-4-methyl-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6R)-6-[(3,4-dichlorophenyl)carbamoyl]-4-methylcyclohex-3-ene-1-carboxylate Traditional Name: (1S,6R)-6-[(3,4-dichlorophenyl)carbamoyl]-4-methyl-cyclohex-3-ene-1-carboxylate Formula: C15H14Cl2NO3- MolecularWeight: 327.18256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(C(C1)C(=O)NC2=CC(=C(C=C2)Cl)Cl)C(=O)[O-]

Isomeric SMILES

CC1=CC[C@@H]([C@@H](C1)C(=O)NC2=CC(=C(C=C2)Cl)Cl)C(=O)[O-]

InChI

InChI=1S/C15H15Cl2NO3/c1-8-2-4-10(15(20)21)11(6-8)14(19)18-9-3-5-12(16)13(17)7-9/h2-3,5,7,10-11H,4,6H2,1H3,(H,18,19)(H,20,21)/p-1/t10-,11+/m0/s1