2-octadecan-2-yl-5-(phenylsulfonyl)benzene-1,4-diol

Systemtic Name: 2-octadecan-2-yl-5-(phenylsulfonyl)benzene-1,4-diol Openeye Name: 2-(benzenesulfonyl)-5-(1-methylheptadecyl)benzene-1,4-diol CAS Name: 2-(benzenesulfonyl)-5-octadecan-2-ylbenzene-1,4-diol IUPAC Name: 2-(benzenesulfonyl)-5-octadecan-2-ylbenzene-1,4-diol Traditional Name: 2-besyl-5-(1-methylheptadecyl)hydroquinone Formula: C30H46O4S MolecularWeight: 502.74884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C)C1=CC(=C(C=C1O)S(=O)(=O)C2=CC=CC=C2)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C)C1=CC(=C(C=C1O)S(=O)(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C30H46O4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20-25(2)27-23-29(32)30(24-28(27)31)35(33,34)26-21-18-16-19-22-26/h16,18-19,21-25,31-32H,3-15,17,20H2,1-2H3