1,4-bis(chloranyl)-5-oxidanyl-8-(2-piperidin-1-ylethylamino)anthracene-9,10-dione

Systemtic Name: 1,4-bis(chloranyl)-5-oxidanyl-8-(2-piperidin-1-ylethylamino)anthracene-9,10-dione Openeye Name: 1,4-dichloro-5-hydroxy-8-[2-(1-piperidyl)ethylamino]anthracene-9,10-dione CAS Name: 1,4-dichloro-5-hydroxy-8-[2-(1-piperidinyl)ethylamino]anthracene-9,10-dione IUPAC Name: 1,4-dichloro-5-hydroxy-8-(2-piperidin-1-ylethylamino)anthracene-9,10-dione Traditional Name: 1,4-dichloro-5-hydroxy-8-(2-piperidinoethylamino)-9,10-anthraquinone Formula: C21H20Cl2N2O3 MolecularWeight: 419.3011

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCNC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)Cl)Cl

Isomeric SMILES

C1CCN(CC1)CCNC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)Cl)Cl

InChI

InChI=1S/C21H20Cl2N2O3/c22-12-4-5-13(23)17-16(12)20(27)18-14(6-7-15(26)19(18)21(17)28)24-8-11-25-9-2-1-3-10-25/h4-7,24,26H,1-3,8-11H2