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

Systemtic Name: [(E)-6-(2,5-dimethoxy-3,4,6-trimethyl-phenyl)-6-pyridin-3-yl-hex-5-enyl] ethanoate Openeye Name: [(E)-6-(2,5-dimethoxy-3,4,6-trimethyl-phenyl)-6-(3-pyridyl)hex-5-enyl] acetate CAS Name: acetic acid [(E)-6-(2,5-dimethoxy-3,4,6-trimethylphenyl)-6-(3-pyridinyl)hex-5-enyl] ester IUPAC Name: [(E)-6-(2,5-dimethoxy-3,4,6-trimethylphenyl)-6-pyridin-3-ylhex-5-enyl] acetate Traditional Name: acetic acid [(E)-6-(2,5-dimethoxy-3,4,6-trimethyl-phenyl)-6-(3-pyridyl)hex-5-enyl] ester Formula: C24H31NO4 MolecularWeight: 397.50724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)OC)C(=CCCCCOC(=O)C)C2=CN=CC=C2)C)OC

Isomeric SMILES

CC1=C(C(=C(C(=C1C)OC)/C(=C/CCCCOC(=O)C)/C2=CN=CC=C2)C)OC

InChI

InChI=1S/C24H31NO4/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/h10-13,15H,7-9,14H2,1-6H3/b21-12+