(E)-4-cyclopropyl-3,5-bis(oxidanyl)-2,6-diphenyl-7-pyrimidin-5-yl-hept-6-enoic acid

Systemtic Name: (E)-4-cyclopropyl-3,5-bis(oxidanyl)-2,6-diphenyl-7-pyrimidin-5-yl-hept-6-enoic acid Openeye Name: (E)-4-cyclopropyl-3,5-dihydroxy-2,6-diphenyl-7-pyrimidin-5-yl-hept-6-enoic acid CAS Name: (E)-4-cyclopropyl-3,5-dihydroxy-2,6-diphenyl-7-(5-pyrimidinyl)-6-heptenoic acid IUPAC Name: (E)-4-cyclopropyl-3,5-dihydroxy-2,6-diphenyl-7-pyrimidin-5-ylhept-6-enoic acid Traditional Name: (E)-4-cyclopropyl-3,5-dihydroxy-2,6-diphenyl-7-(5-pyrimidyl)hept-6-enoic acid Formula: C26H26N2O4 MolecularWeight: 430.49564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(C(C(C2=CC=CC=C2)C(=O)O)O)C(C(=CC3=CN=CN=C3)C4=CC=CC=C4)O

Isomeric SMILES

C1CC1C(C(C(C2=CC=CC=C2)C(=O)O)O)C(/C(=C/C3=CN=CN=C3)/C4=CC=CC=C4)O

InChI

InChI=1S/C26H26N2O4/c29-24(21(18-7-3-1-4-8-18)13-17-14-27-16-28-15-17)22(20-11-12-20)25(30)23(26(31)32)19-9-5-2-6-10-19/h1-10,13-16,20,22-25,29-30H,11-12H2,(H,31,32)/b21-13+