2-[1-[3,5-bis(pentadecan-7-yloxymethylamino)phenyl]ethyl]benzene-1,4-diol

Systemtic Name: 2-[1-[3,5-bis(pentadecan-7-yloxymethylamino)phenyl]ethyl]benzene-1,4-diol Openeye Name: 2-[1-[3,5-bis(1-hexylnonoxymethylamino)phenyl]ethyl]benzene-1,4-diol CAS Name: 2-[1-[3,5-bis(pentadecan-7-yloxymethylamino)phenyl]ethyl]benzene-1,4-diol IUPAC Name: 2-[1-[3,5-bis(pentadecan-7-yloxymethylamino)phenyl]ethyl]benzene-1,4-diol Traditional Name: 2-[1-[3,5-bis(1-hexylnonoxymethylamino)phenyl]ethyl]hydroquinone Formula: C46H80N2O4 MolecularWeight: 725.1384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCCCC)OCNC1=CC(=CC(=C1)C(C)C2=C(C=CC(=C2)O)O)NCOC(CCCCCC)CCCCCCCC

Isomeric SMILES

CCCCCCCCC(CCCCCC)OCNC1=CC(=CC(=C1)C(C)C2=C(C=CC(=C2)O)O)NCOC(CCCCCC)CCCCCCCC

InChI

InChI=1S/C46H80N2O4/c1-6-10-14-18-20-24-28-43(26-22-16-12-8-3)51-36-47-40-32-39(38(5)45-35-42(49)30-31-46(45)50)33-41(34-40)48-37-52-44(27-23-17-13-9-4)29-25-21-19-15-11-7-2/h30-35,38,43-44,47-50H,6-29,36-37H2,1-5H3