3-[[bis(2-hydroxyethyl)amino]methyl]-1,6,8-trimethoxy-anthracene-9,10-dione

Systemtic Name: 3-[[bis(2-hydroxyethyl)amino]methyl]-1,6,8-trimethoxy-anthracene-9,10-dione Openeye Name: 3-[[bis(2-hydroxyethyl)amino]methyl]-1,6,8-trimethoxy-anthracene-9,10-dione CAS Name: 3-[[bis(2-hydroxyethyl)amino]methyl]-1,6,8-trimethoxyanthracene-9,10-dione IUPAC Name: 3-[[bis(2-hydroxyethyl)amino]methyl]-1,6,8-trimethoxyanthracene-9,10-dione Traditional Name: 3-[[bis(2-hydroxyethyl)amino]methyl]-1,6,8-trimethoxy-9,10-anthraquinone Formula: C22H25NO7 MolecularWeight: 415.4364

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)C(=O)C3=CC(=CC(=C3C2=O)OC)CN(CCO)CCO)OC

Isomeric SMILES

COC1=CC(=C2C(=C1)C(=O)C3=CC(=CC(=C3C2=O)OC)CN(CCO)CCO)OC

InChI

InChI=1S/C22H25NO7/c1-28-14-10-16-20(18(11-14)30-3)22(27)19-15(21(16)26)8-13(9-17(19)29-2)12-23(4-6-24)5-7-25/h8-11,24-25H,4-7,12H2,1-3H3