1,2-diphenylbenzene; 3-methylhenicosane-1,2,3-triol

Systemtic Name: 1,2-diphenylbenzene; 3-methylhenicosane-1,2,3-triol Openeye Name: 1,2-diphenylbenzene; 3-methylhenicosane-1,2,3-triol CAS Name: 1,2-diphenylbenzene; 3-methylheneicosane-1,2,3-triol IUPAC Name: 1,2-diphenylbenzene; 3-methylhenicosane-1,2,3-triol Traditional Name: 1,2-diphenylbenzene; 3-methylheneicosane-1,2,3-triol Formula: C40H60O3 MolecularWeight: 588.9026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(C)(C(CO)O)O.C1=CC=C(C=C1)C2=CC=CC=C2C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(C)(C(CO)O)O.C1=CC=C(C=C1)C2=CC=CC=C2C3=CC=CC=C3

InChI

InChI=1S/C22H46O3.C18H14/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(2,25)21(24)20-23;1-3-9-15(10-4-1)17-13-7-8-14-18(17)16-11-5-2-6-12-16/h21,23-25H,3-20H2,1-2H3;1-14H