tridecyl 3-(5-tert-butylcyclohexa-1,5-dien-1-yl)propanoate

Systemtic Name: tridecyl 3-(5-tert-butylcyclohexa-1,5-dien-1-yl)propanoate Openeye Name: tridecyl 3-(5-tert-butylcyclohexa-1,5-dien-1-yl)propanoate CAS Name: 3-(5-tert-butyl-1-cyclohexa-1,5-dienyl)propanoic acid tridecyl ester IUPAC Name: tridecyl 3-(5-tert-butylcyclohexa-1,5-dien-1-yl)propanoate Traditional Name: 3-(5-tert-butylcyclohexa-1,5-dien-1-yl)propionic acid tridecyl ester Formula: C26H46O2 MolecularWeight: 390.64224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCOC(=O)CCC1=CCCC(=C1)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCOC(=O)CCC1=CCCC(=C1)C(C)(C)C

InChI

InChI=1S/C26H46O2/c1-5-6-7-8-9-10-11-12-13-14-15-21-28-25(27)20-19-23-17-16-18-24(22-23)26(2,3)4/h17,22H,5-16,18-21H2,1-4H3