2-azanyl-2-[4-[2-(4-methylphenyl)ethynyl]phenyl]carbonyl-butanoic acid

Systemtic Name: 2-azanyl-2-[4-[2-(4-methylphenyl)ethynyl]phenyl]carbonyl-butanoic acid Openeye Name: 2-amino-2-[4-[2-(p-tolyl)ethynyl]benzoyl]butanoic acid CAS Name: 2-amino-2-[[4-[2-(4-methylphenyl)ethynyl]phenyl]-oxomethyl]butanoic acid IUPAC Name: 2-amino-2-[4-[2-(4-methylphenyl)ethynyl]benzoyl]butanoic acid Traditional Name: 2-amino-2-[4-[2-(p-tolyl)ethynyl]benzoyl]butyric acid Formula: C20H19NO3 MolecularWeight: 321.36976

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C)(C(=O)O)N

Isomeric SMILES

CCC(C(=O)C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C)(C(=O)O)N

InChI

InChI=1S/C20H19NO3/c1-3-20(21,19(23)24)18(22)17-12-10-16(11-13-17)9-8-15-6-4-14(2)5-7-15/h4-7,10-13H,3,21H2,1-2H3,(H,23,24)