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

Systemtic Name: 2-[[(E)-5-(4-butylphenyl)-3-phenyl-pent-2-en-4-ynyl]-methyl-amino]ethanoic acid Openeye Name: 2-[[(E)-5-(4-butylphenyl)-3-phenyl-pent-2-en-4-ynyl]-methyl-amino]acetic acid CAS Name: 2-[[(E)-5-(4-butylphenyl)-3-phenylpent-2-en-4-ynyl]-methylamino]acetic acid IUPAC Name: 2-[[(E)-5-(4-butylphenyl)-3-phenylpent-2-en-4-ynyl]-methylamino]acetic acid Traditional Name: 2-[[(E)-5-(4-butylphenyl)-3-phenyl-pent-2-en-4-ynyl]-methyl-amino]acetic acid Formula: C24H27NO2 MolecularWeight: 361.47668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C#CC(=CCN(C)CC(=O)O)C2=CC=CC=C2

Isomeric SMILES

CCCCC1=CC=C(C=C1)C#C/C(=C/CN(C)CC(=O)O)/C2=CC=CC=C2

InChI

InChI=1S/C24H27NO2/c1-3-4-8-20-11-13-21(14-12-20)15-16-23(22-9-6-5-7-10-22)17-18-25(2)19-24(26)27/h5-7,9-14,17H,3-4,8,18-19H2,1-2H3,(H,26,27)/b23-17-