methyl 6-[4-(1,3-benzodioxol-5-yl)-6-phenyl-pyridin-2-yl]oxy-2,2-dimethyl-hexanoate

Systemtic Name: methyl 6-[4-(1,3-benzodioxol-5-yl)-6-phenyl-pyridin-2-yl]oxy-2,2-dimethyl-hexanoate Openeye Name: methyl 6-[[4-(1,3-benzodioxol-5-yl)-6-phenyl-2-pyridyl]oxy]-2,2-dimethyl-hexanoate CAS Name: 6-[[4-(1,3-benzodioxol-5-yl)-6-phenyl-2-pyridinyl]oxy]-2,2-dimethylhexanoic acid methyl ester IUPAC Name: methyl 6-[4-(1,3-benzodioxol-5-yl)-6-phenylpyridin-2-yl]oxy-2,2-dimethylhexanoate Traditional Name: 6-[[4-(1,3-benzodioxol-5-yl)-6-phenyl-2-pyridyl]oxy]-2,2-dimethyl-hexanoic acid methyl ester Formula: C27H29NO5 MolecularWeight: 447.52286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCOC1=CC(=CC(=N1)C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4)C(=O)OC

Isomeric SMILES

CC(C)(CCCCOC1=CC(=CC(=N1)C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4)C(=O)OC

InChI

InChI=1S/C27H29NO5/c1-27(2,26(29)30-3)13-7-8-14-31-25-17-21(15-22(28-25)19-9-5-4-6-10-19)20-11-12-23-24(16-20)33-18-32-23/h4-6,9-12,15-17H,7-8,13-14,18H2,1-3H3