3-(4-hexadecoxyphenyl)-2-(1-hydroxyethyl)-5-methyl-benzene-1,4-diol

Systemtic Name: 3-(4-hexadecoxyphenyl)-2-(1-hydroxyethyl)-5-methyl-benzene-1,4-diol Openeye Name: 3-(4-hexadecoxyphenyl)-2-(1-hydroxyethyl)-5-methyl-benzene-1,4-diol CAS Name: 3-(4-hexadecoxyphenyl)-2-(1-hydroxyethyl)-5-methylbenzene-1,4-diol IUPAC Name: 3-(4-hexadecoxyphenyl)-2-(1-hydroxyethyl)-5-methylbenzene-1,4-diol Traditional Name: 3-(4-cetyloxyphenyl)-2-(1-hydroxyethyl)-5-methyl-hydroquinone Formula: C31H48O4 MolecularWeight: 484.71042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C2=C(C(=CC(=C2C(C)O)O)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C2=C(C(=CC(=C2C(C)O)O)C)O

InChI

InChI=1S/C31H48O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-35-27-20-18-26(19-21-27)30-29(25(3)32)28(33)23-24(2)31(30)34/h18-21,23,25,32-34H,4-17,22H2,1-3H3