6-[butan-2-yl(methyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[butan-2-yl(methyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[methyl(sec-butyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[[butan-2-yl(methyl)amino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[butan-2-yl(methyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[methyl(sec-butyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C13H21NO3 MolecularWeight: 239.31074

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(C)C(=O)C1CC=CCC1C(=O)O

Isomeric SMILES

CCC(C)N(C)C(=O)C1CC=CCC1C(=O)O

InChI

InChI=1S/C13H21NO3/c1-4-9(2)14(3)12(15)10-7-5-6-8-11(10)13(16)17/h5-6,9-11H,4,7-8H2,1-3H3,(H,16,17)