6-(3-methylbutylcarbamoyl)cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-(3-methylbutylcarbamoyl)cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-(isopentylcarbamoyl)cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[(3-methylbutylamino)-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-(3-methylbutylcarbamoyl)cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-(isoamylcarbamoyl)cyclohex-3-ene-1-carboxylic acid Formula: C13H21NO3 MolecularWeight: 239.31074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1CC=CCC1C(=O)O

Isomeric SMILES

CC(C)CCNC(=O)C1CC=CCC1C(=O)O

InChI

InChI=1S/C13H21NO3/c1-9(2)7-8-14-12(15)10-5-3-4-6-11(10)13(16)17/h3-4,9-11H,5-8H2,1-2H3,(H,14,15)(H,16,17)