(1R,6S)-6-[(2-methoxycarbonylphenyl)carbamoyl]-2,4-dimethyl-cyclohex-3-ene-1-carboxylic acid

Systemtic Name: (1R,6S)-6-[(2-methoxycarbonylphenyl)carbamoyl]-2,4-dimethyl-cyclohex-3-ene-1-carboxylic acid Openeye Name: (1R,6S)-6-[(2-methoxycarbonylphenyl)carbamoyl]-2,4-dimethyl-cyclohex-3-ene-1-carboxylic acid CAS Name: (1R,6S)-6-[(2-methoxycarbonylanilino)-oxomethyl]-2,4-dimethyl-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1R,6S)-6-[(2-methoxycarbonylphenyl)carbamoyl]-2,4-dimethylcyclohex-3-ene-1-carboxylic acid Traditional Name: (1R,6S)-6-[(2-carbomethoxyphenyl)carbamoyl]-2,4-dimethyl-cyclohex-3-ene-1-carboxylic acid Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=C(CC(C1C(=O)O)C(=O)NC2=CC=CC=C2C(=O)OC)C

Isomeric SMILES

CC1C=C(C[C@@H]([C@@H]1C(=O)O)C(=O)NC2=CC=CC=C2C(=O)OC)C

InChI

InChI=1S/C18H21NO5/c1-10-8-11(2)15(17(21)22)13(9-10)16(20)19-14-7-5-4-6-12(14)18(23)24-3/h4-8,11,13,15H,9H2,1-3H3,(H,19,20)(H,21,22)/t11?,13-,15+/m0/s1