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

Systemtic Name: 6-[(2-ethylphenyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[(2-ethylphenyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[(2-ethylanilino)-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[(2-ethylphenyl)carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[(2-ethylphenyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C2CC(=C(CC2C(=O)O)C)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C2CC(=C(CC2C(=O)O)C)C

InChI

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