3-(9-butylheptadecan-9-yloxy)benzene-1,2-diol

Systemtic Name: 3-(9-butylheptadecan-9-yloxy)benzene-1,2-diol Openeye Name: 3-(1-butyl-1-octyl-nonoxy)benzene-1,2-diol CAS Name: 3-(9-butylheptadecan-9-yloxy)benzene-1,2-diol IUPAC Name: 3-(9-butylheptadecan-9-yloxy)benzene-1,2-diol Traditional Name: 3-(1-butyl-1-octyl-nonoxy)pyrocatechol Formula: C27H48O3 MolecularWeight: 420.66822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCC)(CCCCCCCC)OC1=CC=CC(=C1O)O

Isomeric SMILES

CCCCCCCCC(CCCC)(CCCCCCCC)OC1=CC=CC(=C1O)O

InChI

InChI=1S/C27H48O3/c1-4-7-10-12-14-16-22-27(21-9-6-3,23-17-15-13-11-8-5-2)30-25-20-18-19-24(28)26(25)29/h18-20,28-29H,4-17,21-23H2,1-3H3