(E)-2,2-dimethyl-8-phenyl-8-pyridin-3-yl-oct-7-enoic acid

Systemtic Name: (E)-2,2-dimethyl-8-phenyl-8-pyridin-3-yl-oct-7-enoic acid Openeye Name: (E)-2,2-dimethyl-8-phenyl-8-(3-pyridyl)oct-7-enoic acid CAS Name: (E)-2,2-dimethyl-8-phenyl-8-(3-pyridinyl)-7-octenoic acid IUPAC Name: (E)-2,2-dimethyl-8-phenyl-8-pyridin-3-yloct-7-enoic acid Traditional Name: (E)-2,2-dimethyl-8-phenyl-8-(3-pyridyl)oct-7-enoic acid Formula: C21H25NO2 MolecularWeight: 323.4287

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(CCCC/C=C(\C1=CC=CC=C1)/C2=CN=CC=C2)C(=O)O

InChI

InChI=1S/C21H25NO2/c1-21(2,20(23)24)14-8-4-7-13-19(17-10-5-3-6-11-17)18-12-9-15-22-16-18/h3,5-6,9-13,15-16H,4,7-8,14H2,1-2H3,(H,23,24)/b19-13+