2-[6-cyano-2-methyl-3-[[1-(phenylmethyl)imidazol-2-yl]methyl]indolizin-1-yl]ethanoic acid

Systemtic Name: 2-[6-cyano-2-methyl-3-[[1-(phenylmethyl)imidazol-2-yl]methyl]indolizin-1-yl]ethanoic acid Openeye Name: 2-[3-[(1-benzylimidazol-2-yl)methyl]-6-cyano-2-methyl-indolizin-1-yl]acetic acid CAS Name: 2-[6-cyano-2-methyl-3-[[1-(phenylmethyl)-2-imidazolyl]methyl]-1-indolizinyl]acetic acid IUPAC Name: 2-[3-[(1-benzylimidazol-2-yl)methyl]-6-cyano-2-methylindolizin-1-yl]acetic acid Traditional Name: 2-[3-[(1-benzylimidazol-2-yl)methyl]-6-cyano-2-methyl-indolizin-1-yl]acetic acid Formula: C23H20N4O2 MolecularWeight: 384.4305

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C=C(C=CC2=C1CC(=O)O)C#N)CC3=NC=CN3CC4=CC=CC=C4

Isomeric SMILES

CC1=C(N2C=C(C=CC2=C1CC(=O)O)C#N)CC3=NC=CN3CC4=CC=CC=C4

InChI

InChI=1S/C23H20N4O2/c1-16-19(11-23(28)29)20-8-7-18(13-24)15-27(20)21(16)12-22-25-9-10-26(22)14-17-5-3-2-4-6-17/h2-10,15H,11-12,14H2,1H3,(H,28,29)