3-[5-(4-methoxyphenyl)-1-[4-(pyridin-4-ylamino)phenyl]pyrrol-2-yl]propanoic acid

Systemtic Name: 3-[5-(4-methoxyphenyl)-1-[4-(pyridin-4-ylamino)phenyl]pyrrol-2-yl]propanoic acid Openeye Name: 3-[5-(4-methoxyphenyl)-1-[4-(4-pyridylamino)phenyl]pyrrol-2-yl]propanoic acid CAS Name: 3-[5-(4-methoxyphenyl)-1-[4-(pyridin-4-ylamino)phenyl]-2-pyrrolyl]propanoic acid IUPAC Name: 3-[5-(4-methoxyphenyl)-1-[4-(pyridin-4-ylamino)phenyl]pyrrol-2-yl]propanoic acid Traditional Name: 3-[5-(4-methoxyphenyl)-1-[4-(4-pyridylamino)phenyl]pyrrol-2-yl]propionic acid Formula: C25H23N3O3 MolecularWeight: 413.46842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC=C(N2C3=CC=C(C=C3)NC4=CC=NC=C4)CCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC=C(N2C3=CC=C(C=C3)NC4=CC=NC=C4)CCC(=O)O

InChI

InChI=1S/C25H23N3O3/c1-31-23-10-2-18(3-11-23)24-12-8-22(9-13-25(29)30)28(24)21-6-4-19(5-7-21)27-20-14-16-26-17-15-20/h2-8,10-12,14-17H,9,13H2,1H3,(H,26,27)(H,29,30)