4-ethyl-1-(prop-2-ynoylamino)cyclohexane-1-carboxylic acid

Systemtic Name: 4-ethyl-1-(prop-2-ynoylamino)cyclohexane-1-carboxylic acid Openeye Name: 4-ethyl-1-(prop-2-ynoylamino)cyclohexanecarboxylic acid CAS Name: 4-ethyl-1-(1-oxoprop-2-ynylamino)-1-cyclohexanecarboxylic acid IUPAC Name: 4-ethyl-1-(prop-2-ynoylamino)cyclohexane-1-carboxylic acid Traditional Name: 4-ethyl-1-(propioloylamino)cyclohexanecarboxylic acid Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(CC1)(C(=O)O)NC(=O)C#C

Isomeric SMILES

CCC1CCC(CC1)(C(=O)O)NC(=O)C#C

InChI

InChI=1S/C12H17NO3/c1-3-9-5-7-12(8-6-9,11(15)16)13-10(14)4-2/h2,9H,3,5-8H2,1H3,(H,13,14)(H,15,16)