benzene; 2-[[(E)-3,5-diphenylpent-2-en-4-ynyl]-methyl-amino]ethanoic acid

Systemtic Name: benzene; 2-[[(E)-3,5-diphenylpent-2-en-4-ynyl]-methyl-amino]ethanoic acid Openeye Name: benzene; 2-[[(E)-3,5-diphenylpent-2-en-4-ynyl]-methyl-amino]acetic acid CAS Name: benzene; 2-[[(E)-3,5-diphenylpent-2-en-4-ynyl]-methylamino]acetic acid IUPAC Name: benzene; 2-[[(E)-3,5-diphenylpent-2-en-4-ynyl]-methylamino]acetic acid Traditional Name: benzene; 2-[[(E)-3,5-diphenylpent-2-en-4-ynyl]-methyl-amino]acetic acid Formula: C26H25NO2 MolecularWeight: 383.4822

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19NO2.C6H6/c1-21(16-20(22)23)15-14-19(18-10-6-3-7-11-18)13-12-17-8-4-2-5-9-17;1-2-4-6-5-3-1/h2-11,14H,15-16H2,1H3,(H,22,23);1-6H/b19-14-;