3-[4-[2-(dipyridin-2-ylamino)ethoxy]phenyl]propanoic acid

Systemtic Name: 3-[4-[2-(dipyridin-2-ylamino)ethoxy]phenyl]propanoic acid Openeye Name: 3-[4-[2-[bis(2-pyridyl)amino]ethoxy]phenyl]propanoic acid CAS Name: 3-[4-[2-[bis(2-pyridinyl)amino]ethoxy]phenyl]propanoic acid IUPAC Name: 3-[4-[2-(dipyridin-2-ylamino)ethoxy]phenyl]propanoic acid Traditional Name: 3-[4-[2-[bis(2-pyridyl)amino]ethoxy]phenyl]propionic acid Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)N(CCOC2=CC=C(C=C2)CCC(=O)O)C3=CC=CC=N3

Isomeric SMILES

C1=CC=NC(=C1)N(CCOC2=CC=C(C=C2)CCC(=O)O)C3=CC=CC=N3

InChI

InChI=1S/C21H21N3O3/c25-21(26)12-9-17-7-10-18(11-8-17)27-16-15-24(19-5-1-3-13-22-19)20-6-2-4-14-23-20/h1-8,10-11,13-14H,9,12,15-16H2,(H,25,26)