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

Systemtic Name: ethyl 6-[4-(1,3-benzodioxol-5-yl)-6-(2-chlorophenyl)pyridin-2-yl]oxy-2-methyl-hexanoate Openeye Name: ethyl 6-[[4-(1,3-benzodioxol-5-yl)-6-(2-chlorophenyl)-2-pyridyl]oxy]-2-methyl-hexanoate CAS Name: 6-[[4-(1,3-benzodioxol-5-yl)-6-(2-chlorophenyl)-2-pyridinyl]oxy]-2-methylhexanoic acid ethyl ester IUPAC Name: ethyl 6-[4-(1,3-benzodioxol-5-yl)-6-(2-chlorophenyl)pyridin-2-yl]oxy-2-methylhexanoate Traditional Name: 6-[[4-(1,3-benzodioxol-5-yl)-6-(2-chlorophenyl)-2-pyridyl]oxy]-2-methyl-hexanoic acid ethyl ester Formula: C27H28ClNO5 MolecularWeight: 481.96792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)CCCCOC1=CC(=CC(=N1)C2=CC=CC=C2Cl)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)C(C)CCCCOC1=CC(=CC(=N1)C2=CC=CC=C2Cl)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C27H28ClNO5/c1-3-31-27(30)18(2)8-6-7-13-32-26-16-20(19-11-12-24-25(15-19)34-17-33-24)14-23(29-26)21-9-4-5-10-22(21)28/h4-5,9-12,14-16,18H,3,6-8,13,17H2,1-2H3