(1R,6S)-6-(butylcarbamoyl)cyclohex-3-ene-1-carboxylic acid

Systemtic Name: (1R,6S)-6-(butylcarbamoyl)cyclohex-3-ene-1-carboxylic acid Openeye Name: (1R,6S)-6-(butylcarbamoyl)cyclohex-3-ene-1-carboxylic acid CAS Name: (1R,6S)-6-[butylamino(oxo)methyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1R,6S)-6-(butylcarbamoyl)cyclohex-3-ene-1-carboxylic acid Traditional Name: (1R,6S)-6-(butylcarbamoyl)cyclohex-3-ene-1-carboxylic acid Formula: C12H19NO3 MolecularWeight: 225.28416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1CC=CCC1C(=O)O

Isomeric SMILES

CCCCNC(=O)[C@H]1CC=CC[C@H]1C(=O)O

InChI

InChI=1S/C12H19NO3/c1-2-3-8-13-11(14)9-6-4-5-7-10(9)12(15)16/h4-5,9-10H,2-3,6-8H2,1H3,(H,13,14)(H,15,16)/t9-,10+/m0/s1