4-[[5-[2-(4-methylphenyl)ethynyl]furan-2-yl]carbonylamino]butanoic acid

Systemtic Name: 4-[[5-[2-(4-methylphenyl)ethynyl]furan-2-yl]carbonylamino]butanoic acid Openeye Name: 4-[[5-[2-(p-tolyl)ethynyl]furan-2-carbonyl]amino]butanoic acid CAS Name: 4-[[[5-[2-(4-methylphenyl)ethynyl]-2-furanyl]-oxomethyl]amino]butanoic acid IUPAC Name: 4-[[5-[2-(4-methylphenyl)ethynyl]furan-2-carbonyl]amino]butanoic acid Traditional Name: 4-[[5-[2-(p-tolyl)ethynyl]-2-furoyl]amino]butyric acid Formula: C18H17NO4 MolecularWeight: 311.33188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CC2=CC=C(O2)C(=O)NCCCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C#CC2=CC=C(O2)C(=O)NCCCC(=O)O

InChI

InChI=1S/C18H17NO4/c1-13-4-6-14(7-5-13)8-9-15-10-11-16(23-15)18(22)19-12-2-3-17(20)21/h4-7,10-11H,2-3,12H2,1H3,(H,19,22)(H,20,21)