2-[methyl-[(E)-5-(4-methylphenyl)-3-phenyl-pent-2-en-4-ynyl]amino]ethanoic acid

Systemtic Name: 2-[methyl-[(E)-5-(4-methylphenyl)-3-phenyl-pent-2-en-4-ynyl]amino]ethanoic acid Openeye Name: 2-[methyl-[(E)-3-phenyl-5-(p-tolyl)pent-2-en-4-ynyl]amino]acetic acid CAS Name: 2-[methyl-[(E)-5-(4-methylphenyl)-3-phenylpent-2-en-4-ynyl]amino]acetic acid IUPAC Name: 2-[methyl-[(E)-5-(4-methylphenyl)-3-phenylpent-2-en-4-ynyl]amino]acetic acid Traditional Name: 2-[methyl-[(E)-3-phenyl-5-(p-tolyl)pent-2-en-4-ynyl]amino]acetic acid Formula: C21H21NO2 MolecularWeight: 319.39694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CC(=CCN(C)CC(=O)O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)C#C/C(=C/CN(C)CC(=O)O)/C2=CC=CC=C2

InChI

InChI=1S/C21H21NO2/c1-17-8-10-18(11-9-17)12-13-20(19-6-4-3-5-7-19)14-15-22(2)16-21(23)24/h3-11,14H,15-16H2,1-2H3,(H,23,24)/b20-14-