2-[1-methyl-3-(phenylmethyl)-5-[2-(pyridin-2-ylamino)ethoxy]pyrazol-4-yl]propanoic acid

Systemtic Name: 2-[1-methyl-3-(phenylmethyl)-5-[2-(pyridin-2-ylamino)ethoxy]pyrazol-4-yl]propanoic acid Openeye Name: 2-[3-benzyl-1-methyl-5-[2-(2-pyridylamino)ethoxy]pyrazol-4-yl]propanoic acid CAS Name: 2-[1-methyl-3-(phenylmethyl)-5-[2-(2-pyridinylamino)ethoxy]-4-pyrazolyl]propanoic acid IUPAC Name: 2-[3-benzyl-1-methyl-5-[2-(pyridin-2-ylamino)ethoxy]pyrazol-4-yl]propanoic acid Traditional Name: 2-[3-benzyl-1-methyl-5-[2-(2-pyridylamino)ethoxy]pyrazol-4-yl]propionic acid Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(N(N=C1CC2=CC=CC=C2)C)OCCNC3=CC=CC=N3)C(=O)O

Isomeric SMILES

CC(C1=C(N(N=C1CC2=CC=CC=C2)C)OCCNC3=CC=CC=N3)C(=O)O

InChI

InChI=1S/C21H24N4O3/c1-15(21(26)27)19-17(14-16-8-4-3-5-9-16)24-25(2)20(19)28-13-12-23-18-10-6-7-11-22-18/h3-11,15H,12-14H2,1-2H3,(H,22,23)(H,26,27)