3-[(2-chloroethylamino)methyl]-1,6,8-trimethoxy-anthracene-9,10-dione chloride

Systemtic Name: 3-[(2-chloroethylamino)methyl]-1,6,8-trimethoxy-anthracene-9,10-dione chloride Openeye Name: 3-[(2-chloroethylamino)methyl]-1,6,8-trimethoxy-anthracene-9,10-dione chloride CAS Name: 3-[(2-chloroethylamino)methyl]-1,6,8-trimethoxyanthracene-9,10-dione chloride IUPAC Name: 3-[(2-chloroethylamino)methyl]-1,6,8-trimethoxyanthracene-9,10-dione chloride Traditional Name: 3-[(2-chloroethylamino)methyl]-1,6,8-trimethoxy-9,10-anthraquinone chloride Formula: C20H20Cl2NO5- MolecularWeight: 425.2825

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)C(=O)C3=CC(=CC(=C3C2=O)OC)CNCCCl)OC.[Cl-]

Isomeric SMILES

COC1=CC(=C2C(=C1)C(=O)C3=CC(=CC(=C3C2=O)OC)CNCCCl)OC.[Cl-]

InChI

InChI=1S/C20H20ClNO5.ClH/c1-25-12-8-14-18(16(9-12)27-3)20(24)17-13(19(14)23)6-11(7-15(17)26-2)10-22-5-4-21;/h6-9,22H,4-5,10H2,1-3H3;1H/p-1