3,5-bis(oxidanyl)-2-(6-phenylpyridin-3-yl)-2-propan-2-yl-hept-6-enoic acid

Systemtic Name: 3,5-bis(oxidanyl)-2-(6-phenylpyridin-3-yl)-2-propan-2-yl-hept-6-enoic acid Openeye Name: 3,5-dihydroxy-2-isopropyl-2-(6-phenyl-3-pyridyl)hept-6-enoic acid CAS Name: 3,5-dihydroxy-2-(6-phenyl-3-pyridinyl)-2-propan-2-yl-6-heptenoic acid IUPAC Name: 3,5-dihydroxy-2-(6-phenylpyridin-3-yl)-2-propan-2-ylhept-6-enoic acid Traditional Name: 3,5-dihydroxy-2-isopropyl-2-(6-phenyl-3-pyridyl)hept-6-enoic acid Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO4/c1-4-17(23)12-19(24)21(14(2)3,20(25)26)16-10-11-18(22-13-16)15-8-6-5-7-9-15/h4-11,13-14,17,19,23-24H,1,12H2,2-3H3,(H,25,26)