6-[methyl(pentyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[methyl(pentyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[methyl(pentyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[[methyl(pentyl)amino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[methyl(pentyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[amyl(methyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C14H23NO3 MolecularWeight: 253.33732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C)C(=O)C1CC=CCC1C(=O)O

Isomeric SMILES

CCCCCN(C)C(=O)C1CC=CCC1C(=O)O

InChI

InChI=1S/C14H23NO3/c1-3-4-7-10-15(2)13(16)11-8-5-6-9-12(11)14(17)18/h5-6,11-12H,3-4,7-10H2,1-2H3,(H,17,18)