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

Systemtic Name: 6-[(3-cyclohexylpropanoylamino)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[(3-cyclohexylpropanoylamino)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[[(3-cyclohexyl-1-oxopropyl)hydrazo]-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[(3-cyclohexylpropanoylamino)carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[(3-cyclohexylpropanoylamino)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid Formula: C19H30N2O4 MolecularWeight: 350.4525

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1)C(=O)NNC(=O)CCC2CCCCC2)C(=O)O)C

Isomeric SMILES

CC1=C(CC(C(C1)C(=O)NNC(=O)CCC2CCCCC2)C(=O)O)C

InChI

InChI=1S/C19H30N2O4/c1-12-10-15(16(19(24)25)11-13(12)2)18(23)21-20-17(22)9-8-14-6-4-3-5-7-14/h14-16H,3-11H2,1-2H3,(H,20,22)(H,21,23)(H,24,25)