1-(3-phenylprop-2-ynoylamino)cyclohexane-1-carboxylic acid

Systemtic Name: 1-(3-phenylprop-2-ynoylamino)cyclohexane-1-carboxylic acid Openeye Name: 1-(3-phenylprop-2-ynoylamino)cyclohexanecarboxylic acid CAS Name: 1-[(1-oxo-3-phenylprop-2-ynyl)amino]-1-cyclohexanecarboxylic acid IUPAC Name: 1-(3-phenylprop-2-ynoylamino)cyclohexane-1-carboxylic acid Traditional Name: 1-[(3-phenylpropioloyl)amino]cyclohexanecarboxylic acid Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)O)NC(=O)C#CC2=CC=CC=C2

Isomeric SMILES

C1CCC(CC1)(C(=O)O)NC(=O)C#CC2=CC=CC=C2

InChI

InChI=1S/C16H17NO3/c18-14(10-9-13-7-3-1-4-8-13)17-16(15(19)20)11-5-2-6-12-16/h1,3-4,7-8H,2,5-6,11-12H2,(H,17,18)(H,19,20)