1,4-bis[2-[3-(chloromethyl)piperidin-1-yl]ethylamino]anthracene-9,10-dione

Systemtic Name: 1,4-bis[2-[3-(chloromethyl)piperidin-1-yl]ethylamino]anthracene-9,10-dione Openeye Name: 1,4-bis[2-[3-(chloromethyl)-1-piperidyl]ethylamino]anthracene-9,10-dione CAS Name: 1,4-bis[2-[3-(chloromethyl)-1-piperidinyl]ethylamino]anthracene-9,10-dione IUPAC Name: 1,4-bis[2-[3-(chloromethyl)piperidin-1-yl]ethylamino]anthracene-9,10-dione Traditional Name: 1,4-bis[2-[3-(chloromethyl)piperidino]ethylamino]-9,10-anthraquinone Formula: C30H38Cl2N4O2 MolecularWeight: 557.55432

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCNC2=C3C(=C(C=C2)NCCN4CCCC(C4)CCl)C(=O)C5=CC=CC=C5C3=O)CCl

Isomeric SMILES

C1CC(CN(C1)CCNC2=C3C(=C(C=C2)NCCN4CCCC(C4)CCl)C(=O)C5=CC=CC=C5C3=O)CCl

InChI

InChI=1S/C30H38Cl2N4O2/c31-17-21-5-3-13-35(19-21)15-11-33-25-9-10-26(34-12-16-36-14-4-6-22(18-32)20-36)28-27(25)29(37)23-7-1-2-8-24(23)30(28)38/h1-2,7-10,21-22,33-34H,3-6,11-20H2