2-[[4-[2-(1-oxidanylcyclohexyl)ethynyl]phenyl]carbonylamino]butanoic acid

Systemtic Name: 2-[[4-[2-(1-oxidanylcyclohexyl)ethynyl]phenyl]carbonylamino]butanoic acid Openeye Name: 2-[[4-[2-(1-hydroxycyclohexyl)ethynyl]benzoyl]amino]butanoic acid CAS Name: 2-[[[4-[2-(1-hydroxycyclohexyl)ethynyl]phenyl]-oxomethyl]amino]butanoic acid IUPAC Name: 2-[[4-[2-(1-hydroxycyclohexyl)ethynyl]benzoyl]amino]butanoic acid Traditional Name: 2-[[4-[2-(1-hydroxycyclohexyl)ethynyl]benzoyl]amino]butyric acid Formula: C19H23NO4 MolecularWeight: 329.39022

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)C1=CC=C(C=C1)C#CC2(CCCCC2)O

Isomeric SMILES

CCC(C(=O)O)NC(=O)C1=CC=C(C=C1)C#CC2(CCCCC2)O

InChI

InChI=1S/C19H23NO4/c1-2-16(18(22)23)20-17(21)15-8-6-14(7-9-15)10-13-19(24)11-4-3-5-12-19/h6-9,16,24H,2-5,11-12H2,1H3,(H,20,21)(H,22,23)