2-(3,4-dimethoxyphenyl)ethyl 1-[(2E)-3,7-dimethylocta-2,6-dienoyl]piperidine-2-carboxylate

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl 1-[(2E)-3,7-dimethylocta-2,6-dienoyl]piperidine-2-carboxylate Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl 1-[(2E)-3,7-dimethylocta-2,6-dienoyl]piperidine-2-carboxylate CAS Name: 1-[(2E)-3,7-dimethyl-1-oxoocta-2,6-dienyl]-2-piperidinecarboxylic acid 2-(3,4-dimethoxyphenyl)ethyl ester IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl 1-[(2E)-3,7-dimethylocta-2,6-dienoyl]piperidine-2-carboxylate Traditional Name: 1-[(2E)-3,7-dimethylocta-2,6-dienoyl]pipecolinic acid homoveratryl ester Formula: C26H37NO5 MolecularWeight: 443.57568

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CC(=O)N1CCCCC1C(=O)OCCC2=CC(=C(C=C2)OC)OC)C)C

Isomeric SMILES

CC(=CCC/C(=C/C(=O)N1CCCCC1C(=O)OCCC2=CC(=C(C=C2)OC)OC)/C)C

InChI

InChI=1S/C26H37NO5/c1-19(2)9-8-10-20(3)17-25(28)27-15-7-6-11-22(27)26(29)32-16-14-21-12-13-23(30-4)24(18-21)31-5/h9,12-13,17-18,22H,6-8,10-11,14-16H2,1-5H3/b20-17+