2-[(E)-3,7,11,15,19,23,27-heptamethyloctacos-18-enyl]-5,6-dimethoxy-3-methyl-benzene-1,4-diol

Systemtic Name: 2-[(E)-3,7,11,15,19,23,27-heptamethyloctacos-18-enyl]-5,6-dimethoxy-3-methyl-benzene-1,4-diol Openeye Name: 2-[(E)-3,7,11,15,19,23,27-heptamethyloctacos-18-enyl]-5,6-dimethoxy-3-methyl-benzene-1,4-diol CAS Name: 2-[(E)-3,7,11,15,19,23,27-heptamethyloctacos-18-enyl]-5,6-dimethoxy-3-methylbenzene-1,4-diol IUPAC Name: 2-[(E)-3,7,11,15,19,23,27-heptamethyloctacos-18-enyl]-5,6-dimethoxy-3-methylbenzene-1,4-diol Traditional Name: 2-[(E)-3,7,11,15,19,23,27-heptamethyloctacos-18-enyl]-5,6-dimethoxy-3-methyl-hydroquinone Formula: C44H80O4 MolecularWeight: 673.1036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1O)OC)OC)O)CCC(C)CCCC(C)CCCC(C)CCCC(C)CCC=C(C)CCCC(C)CCCC(C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1O)OC)OC)O)CCC(C)CCCC(C)CCCC(C)CCCC(C)CC/C=C(\C)/CCCC(C)CCCC(C)C

InChI

InChI=1S/C44H80O4/c1-32(2)18-12-19-33(3)20-13-21-34(4)22-14-23-35(5)24-15-25-36(6)26-16-27-37(7)28-17-29-38(8)30-31-40-39(9)41(45)43(47-10)44(48-11)42(40)46/h22,32-33,35-38,45-46H,12-21,23-31H2,1-11H3/b34-22+