2-[6-cyano-2-methyl-3-[(4-pyrimidin-2-yloxyphenyl)methyl]indolizin-1-yl]ethanoic acid

Systemtic Name: 2-[6-cyano-2-methyl-3-[(4-pyrimidin-2-yloxyphenyl)methyl]indolizin-1-yl]ethanoic acid Openeye Name: 2-[6-cyano-2-methyl-3-[(4-pyrimidin-2-yloxyphenyl)methyl]indolizin-1-yl]acetic acid CAS Name: 2-[6-cyano-2-methyl-3-[[4-(2-pyrimidinyloxy)phenyl]methyl]-1-indolizinyl]acetic acid IUPAC Name: 2-[6-cyano-2-methyl-3-[(4-pyrimidin-2-yloxyphenyl)methyl]indolizin-1-yl]acetic acid Traditional Name: 2-[6-cyano-2-methyl-3-[4-(2-pyrimidyloxy)benzyl]indolizin-1-yl]acetic acid Formula: C23H18N4O3 MolecularWeight: 398.41402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C=C(C=CC2=C1CC(=O)O)C#N)CC3=CC=C(C=C3)OC4=NC=CC=N4

Isomeric SMILES

CC1=C(N2C=C(C=CC2=C1CC(=O)O)C#N)CC3=CC=C(C=C3)OC4=NC=CC=N4

InChI

InChI=1S/C23H18N4O3/c1-15-19(12-22(28)29)20-8-5-17(13-24)14-27(20)21(15)11-16-3-6-18(7-4-16)30-23-25-9-2-10-26-23/h2-10,14H,11-12H2,1H3,(H,28,29)