ethyl 6-[4-(3-methoxyphenyl)-6-phenyl-pyridin-2-yl]oxy-2-methyl-hexanoate

Systemtic Name: ethyl 6-[4-(3-methoxyphenyl)-6-phenyl-pyridin-2-yl]oxy-2-methyl-hexanoate Openeye Name: ethyl 6-[[4-(3-methoxyphenyl)-6-phenyl-2-pyridyl]oxy]-2-methyl-hexanoate CAS Name: 6-[[4-(3-methoxyphenyl)-6-phenyl-2-pyridinyl]oxy]-2-methylhexanoic acid ethyl ester IUPAC Name: ethyl 6-[4-(3-methoxyphenyl)-6-phenylpyridin-2-yl]oxy-2-methylhexanoate Traditional Name: 6-[[4-(3-methoxyphenyl)-6-phenyl-2-pyridyl]oxy]-2-methyl-hexanoic acid ethyl ester Formula: C27H31NO4 MolecularWeight: 433.53934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)CCCCOC1=CC(=CC(=N1)C2=CC=CC=C2)C3=CC(=CC=C3)OC

Isomeric SMILES

CCOC(=O)C(C)CCCCOC1=CC(=CC(=N1)C2=CC=CC=C2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C27H31NO4/c1-4-31-27(29)20(2)11-8-9-16-32-26-19-23(22-14-10-15-24(17-22)30-3)18-25(28-26)21-12-6-5-7-13-21/h5-7,10,12-15,17-20H,4,8-9,11,16H2,1-3H3