6-(4-decoxyphenoxy)hex-2-ynyl 2-methylpropanoate

Systemtic Name: 6-(4-decoxyphenoxy)hex-2-ynyl 2-methylpropanoate Openeye Name: 6-(4-decoxyphenoxy)hex-2-ynyl 2-methylpropanoate CAS Name: 2-methylpropanoic acid 6-(4-decoxyphenoxy)hex-2-ynyl ester IUPAC Name: 6-(4-decoxyphenoxy)hex-2-ynyl 2-methylpropanoate Traditional Name: 2-methylpropionic acid 6-(4-decoxyphenoxy)hex-2-ynyl ester Formula: C26H40O4 MolecularWeight: 416.5934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)OCCCC#CCOC(=O)C(C)C

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)OCCCC#CCOC(=O)C(C)C

InChI

InChI=1S/C26H40O4/c1-4-5-6-7-8-9-10-13-20-28-24-16-18-25(19-17-24)29-21-14-11-12-15-22-30-26(27)23(2)3/h16-19,23H,4-11,13-14,20-22H2,1-3H3