1-(2-phenylbutanoylamino)cyclohexane-1-carboxylic acid

Systemtic Name: 1-(2-phenylbutanoylamino)cyclohexane-1-carboxylic acid Openeye Name: 1-(2-phenylbutanoylamino)cyclohexanecarboxylic acid CAS Name: 1-[(1-oxo-2-phenylbutyl)amino]-1-cyclohexanecarboxylic acid IUPAC Name: 1-(2-phenylbutanoylamino)cyclohexane-1-carboxylic acid Traditional Name: 1-(2-phenylbutanoylamino)cyclohexanecarboxylic acid Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2(CCCCC2)C(=O)O

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC2(CCCCC2)C(=O)O

InChI

InChI=1S/C17H23NO3/c1-2-14(13-9-5-3-6-10-13)15(19)18-17(16(20)21)11-7-4-8-12-17/h3,5-6,9-10,14H,2,4,7-8,11-12H2,1H3,(H,18,19)(H,20,21)