3-(hydroxymethyl)-1,8-dipropoxy-anthracene-9,10-dione

Systemtic Name: 3-(hydroxymethyl)-1,8-dipropoxy-anthracene-9,10-dione Openeye Name: 3-(hydroxymethyl)-1,8-dipropoxy-anthracene-9,10-dione CAS Name: 3-(hydroxymethyl)-1,8-dipropoxyanthracene-9,10-dione IUPAC Name: 3-(hydroxymethyl)-1,8-dipropoxyanthracene-9,10-dione Traditional Name: 3-methylol-1,8-dipropoxy-9,10-anthraquinone Formula: C21H22O5 MolecularWeight: 354.39638

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC2=C1C(=O)C3=C(C=C(C=C3C2=O)CO)OCCC

Isomeric SMILES

CCCOC1=CC=CC2=C1C(=O)C3=C(C=C(C=C3C2=O)CO)OCCC

InChI

InChI=1S/C21H22O5/c1-3-8-25-16-7-5-6-14-18(16)21(24)19-15(20(14)23)10-13(12-22)11-17(19)26-9-4-2/h5-7,10-11,22H,3-4,8-9,12H2,1-2H3