4-methyl-1-(3-methylbut-2-enoylamino)cyclohexane-1-carboxylic acid

Systemtic Name: 4-methyl-1-(3-methylbut-2-enoylamino)cyclohexane-1-carboxylic acid Openeye Name: 4-methyl-1-(3-methylbut-2-enoylamino)cyclohexanecarboxylic acid CAS Name: 4-methyl-1-[(3-methyl-1-oxobut-2-enyl)amino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-methyl-1-(3-methylbut-2-enoylamino)cyclohexane-1-carboxylic acid Traditional Name: 4-methyl-1-(3-methylbut-2-enoylamino)cyclohexanecarboxylic acid Formula: C13H21NO3 MolecularWeight: 239.31074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C(=O)O)NC(=O)C=C(C)C

Isomeric SMILES

CC1CCC(CC1)(C(=O)O)NC(=O)C=C(C)C

InChI

InChI=1S/C13H21NO3/c1-9(2)8-11(15)14-13(12(16)17)6-4-10(3)5-7-13/h8,10H,4-7H2,1-3H3,(H,14,15)(H,16,17)