1-(2-dimethylaminoethylamino)-5-(4-methylpiperazin-1-yl)-4,8-bis(oxidanyl)anthracene-9,10-dione

Systemtic Name: 1-(2-dimethylaminoethylamino)-5-(4-methylpiperazin-1-yl)-4,8-bis(oxidanyl)anthracene-9,10-dione Openeye Name: 1-(2-dimethylaminoethylamino)-4,8-dihydroxy-5-(4-methylpiperazin-1-yl)anthracene-9,10-dione CAS Name: 1-(2-dimethylaminoethylamino)-4,8-dihydroxy-5-(4-methyl-1-piperazinyl)anthracene-9,10-dione IUPAC Name: 1-(2-dimethylaminoethylamino)-4,8-dihydroxy-5-(4-methylpiperazin-1-yl)anthracene-9,10-dione Traditional Name: 1-(2-dimethylaminoethylamino)-4,8-dihydroxy-5-(4-methylpiperazino)-9,10-anthraquinone Formula: C23H28N4O4 MolecularWeight: 424.49282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)O)NCCN(C)C

Isomeric SMILES

CN1CCN(CC1)C2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)O)NCCN(C)C

InChI

InChI=1S/C23H28N4O4/c1-25(2)9-8-24-14-4-6-16(28)20-18(14)22(30)21-17(29)7-5-15(19(21)23(20)31)27-12-10-26(3)11-13-27/h4-7,24,28-29H,8-13H2,1-3H3