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

Systemtic Name: 3,5-bis(oxidanyl)-6-phenyl-2-propan-2-yl-2-pyridin-3-yl-hept-6-enoic acid Openeye Name: 3,5-dihydroxy-2-isopropyl-6-phenyl-2-(3-pyridyl)hept-6-enoic acid CAS Name: 3,5-dihydroxy-6-phenyl-2-propan-2-yl-2-(3-pyridinyl)-6-heptenoic acid IUPAC Name: 3,5-dihydroxy-6-phenyl-2-propan-2-yl-2-pyridin-3-ylhept-6-enoic acid Traditional Name: 3,5-dihydroxy-2-isopropyl-6-phenyl-2-(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=CC=C1)(C(CC(C(=C)C2=CC=CC=C2)O)O)C(=O)O

Isomeric SMILES

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

InChI

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