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

Systemtic Name: 2-[methyl-[(E)-3-phenyl-5-quinolin-2-yl-pent-2-en-4-ynyl]amino]ethanoic acid Openeye Name: 2-[methyl-[(E)-3-phenyl-5-(2-quinolyl)pent-2-en-4-ynyl]amino]acetic acid CAS Name: 2-[methyl-[(E)-3-phenyl-5-(2-quinolinyl)pent-2-en-4-ynyl]amino]acetic acid IUPAC Name: 2-[methyl-[(E)-3-phenyl-5-quinolin-2-ylpent-2-en-4-ynyl]amino]acetic acid Traditional Name: 2-[methyl-[(E)-3-phenyl-5-(2-quinolyl)pent-2-en-4-ynyl]amino]acetic acid Formula: C23H20N2O2 MolecularWeight: 356.4171

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC=C(C#CC1=NC2=CC=CC=C2C=C1)C3=CC=CC=C3)CC(=O)O

Isomeric SMILES

CN(C/C=C(/C#CC1=NC2=CC=CC=C2C=C1)\C3=CC=CC=C3)CC(=O)O

InChI

InChI=1S/C23H20N2O2/c1-25(17-23(26)27)16-15-19(18-7-3-2-4-8-18)11-13-21-14-12-20-9-5-6-10-22(20)24-21/h2-10,12,14-15H,16-17H2,1H3,(H,26,27)/b19-15-