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

Systemtic Name: 2-[methyl-[(E)-3-phenyl-5-(4-propan-2-ylphenyl)pent-2-en-4-ynyl]amino]ethanoic acid Openeye Name: 2-[[(E)-5-(4-isopropylphenyl)-3-phenyl-pent-2-en-4-ynyl]-methyl-amino]acetic acid CAS Name: 2-[methyl-[(E)-3-phenyl-5-(4-propan-2-ylphenyl)pent-2-en-4-ynyl]amino]acetic acid IUPAC Name: 2-[methyl-[(E)-3-phenyl-5-(4-propan-2-ylphenyl)pent-2-en-4-ynyl]amino]acetic acid Traditional Name: 2-[methyl-[(E)-5-p-cumenyl-3-phenyl-pent-2-en-4-ynyl]amino]acetic acid Formula: C23H25NO2 MolecularWeight: 347.4501

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25NO2/c1-18(2)20-12-9-19(10-13-20)11-14-22(21-7-5-4-6-8-21)15-16-24(3)17-23(25)26/h4-10,12-13,15,18H,16-17H2,1-3H3,(H,25,26)/b22-15-