(1S,6S)-6-[(3,4-dimethylphenyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: (1S,6S)-6-[(3,4-dimethylphenyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Openeye Name: (1S,6S)-6-[(3,4-dimethylphenyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate CAS Name: (1S,6S)-6-[(3,4-dimethylanilino)-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6S)-6-[(3,4-dimethylphenyl)carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylate Traditional Name: (1S,6S)-6-[(3,4-dimethylphenyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Formula: C18H22NO3- MolecularWeight: 300.37218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO3/c1-10-5-6-14(7-11(10)2)19-17(20)15-8-12(3)13(4)9-16(15)18(21)22/h5-7,15-16H,8-9H2,1-4H3,(H,19,20)(H,21,22)/p-1/t15-,16-/m0/s1