3,5-bis(oxidanyl)-5,6-diphenyl-3-propan-2-yl-2-pyridazin-4-yl-hept-6-enoic acid

Systemtic Name: 3,5-bis(oxidanyl)-5,6-diphenyl-3-propan-2-yl-2-pyridazin-4-yl-hept-6-enoic acid Openeye Name: 3,5-dihydroxy-3-isopropyl-5,6-diphenyl-2-pyridazin-4-yl-hept-6-enoic acid CAS Name: 3,5-dihydroxy-5,6-diphenyl-3-propan-2-yl-2-(4-pyridazinyl)-6-heptenoic acid IUPAC Name: 3,5-dihydroxy-5,6-diphenyl-3-propan-2-yl-2-pyridazin-4-ylhept-6-enoic acid Traditional Name: 3,5-dihydroxy-3-isopropyl-5,6-diphenyl-2-pyridazin-4-yl-hept-6-enoic acid Formula: C26H28N2O4 MolecularWeight: 432.51152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(C1=CC=CC=C1)(C(=C)C2=CC=CC=C2)O)(C(C3=CN=NC=C3)C(=O)O)O

Isomeric SMILES

CC(C)C(CC(C1=CC=CC=C1)(C(=C)C2=CC=CC=C2)O)(C(C3=CN=NC=C3)C(=O)O)O

InChI

InChI=1S/C26H28N2O4/c1-18(2)25(31,23(24(29)30)21-14-15-27-28-16-21)17-26(32,22-12-8-5-9-13-22)19(3)20-10-6-4-7-11-20/h4-16,18,23,31-32H,3,17H2,1-2H3,(H,29,30)