[2-(5-octylpyridin-2-yl)phenyl] 2,2-dimethyl-1,3-dioxolane-4-carboxylate

Systemtic Name: [2-(5-octylpyridin-2-yl)phenyl] 2,2-dimethyl-1,3-dioxolane-4-carboxylate Openeye Name: [2-(5-octyl-2-pyridyl)phenyl] 2,2-dimethyl-1,3-dioxolane-4-carboxylate CAS Name: 2,2-dimethyl-1,3-dioxolane-4-carboxylic acid [2-(5-octyl-2-pyridinyl)phenyl] ester IUPAC Name: [2-(5-octylpyridin-2-yl)phenyl] 2,2-dimethyl-1,3-dioxolane-4-carboxylate Traditional Name: 2,2-dimethyl-1,3-dioxolane-4-carboxylic acid [2-(5-octyl-2-pyridyl)phenyl] ester Formula: C25H33NO4 MolecularWeight: 411.53382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(C=C1)C2=CC=CC=C2OC(=O)C3COC(O3)(C)C

Isomeric SMILES

CCCCCCCCC1=CN=C(C=C1)C2=CC=CC=C2OC(=O)C3COC(O3)(C)C

InChI

InChI=1S/C25H33NO4/c1-4-5-6-7-8-9-12-19-15-16-21(26-17-19)20-13-10-11-14-22(20)29-24(27)23-18-28-25(2,3)30-23/h10-11,13-17,23H,4-9,12,18H2,1-3H3