6-[(4-ethoxycarbonylphenyl)carbamoyl]-1-methyl-cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[(4-ethoxycarbonylphenyl)carbamoyl]-1-methyl-cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[(4-ethoxycarbonylphenyl)carbamoyl]-1-methyl-cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[(4-ethoxycarbonylanilino)-oxomethyl]-1-methyl-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[(4-ethoxycarbonylphenyl)carbamoyl]-1-methylcyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[(4-carbethoxyphenyl)carbamoyl]-1-methyl-cyclohex-3-ene-1-carboxylic acid Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CC=CCC2(C)C(=O)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CC=CCC2(C)C(=O)O

InChI

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