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

Systemtic Name: [5-(2,5-dimethoxy-3,4,6-trimethyl-phenyl)-5-pyridin-3-yl-pentyl] ethanoate Openeye Name: [5-(2,5-dimethoxy-3,4,6-trimethyl-phenyl)-5-(3-pyridyl)pentyl] acetate CAS Name: acetic acid [5-(2,5-dimethoxy-3,4,6-trimethylphenyl)-5-(3-pyridinyl)pentyl] ester IUPAC Name: [5-(2,5-dimethoxy-3,4,6-trimethylphenyl)-5-pyridin-3-ylpentyl] acetate Traditional Name: acetic acid [5-(2,5-dimethoxy-3,4,6-trimethyl-phenyl)-5-(3-pyridyl)pentyl] ester Formula: C23H31NO4 MolecularWeight: 385.49654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31NO4/c1-15-16(2)23(27-6)21(17(3)22(15)26-5)20(19-10-9-12-24-14-19)11-7-8-13-28-18(4)25/h9-10,12,14,20H,7-8,11,13H2,1-6H3