[6-(2,5-dimethoxy-3,4,6-trimethyl-phenyl)-6-pyridin-3-yl-hexyl] ethanoate

Systemtic Name: [6-(2,5-dimethoxy-3,4,6-trimethyl-phenyl)-6-pyridin-3-yl-hexyl] ethanoate Openeye Name: [6-(2,5-dimethoxy-3,4,6-trimethyl-phenyl)-6-(3-pyridyl)hexyl] acetate CAS Name: acetic acid [6-(2,5-dimethoxy-3,4,6-trimethylphenyl)-6-(3-pyridinyl)hexyl] ester IUPAC Name: [6-(2,5-dimethoxy-3,4,6-trimethylphenyl)-6-pyridin-3-ylhexyl] acetate Traditional Name: acetic acid [6-(2,5-dimethoxy-3,4,6-trimethyl-phenyl)-6-(3-pyridyl)hexyl] ester Formula: C24H33NO4 MolecularWeight: 399.52312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1OC)C)C(CCCCCOC(=O)C)C2=CN=CC=C2)OC)C

Isomeric SMILES

CC1=C(C(=C(C(=C1OC)C)C(CCCCCOC(=O)C)C2=CN=CC=C2)OC)C

InChI

InChI=1S/C24H33NO4/c1-16-17(2)24(28-6)22(18(3)23(16)27-5)21(20-11-10-13-25-15-20)12-8-7-9-14-29-19(4)26/h10-11,13,15,21H,7-9,12,14H2,1-6H3