1,4-bis(azanyl)-5-[2-(3-methyl-2H-imidazol-1-yl)ethylamino]anthracene-9,10-dione bromide

Systemtic Name: 1,4-bis(azanyl)-5-[2-(3-methyl-2H-imidazol-1-yl)ethylamino]anthracene-9,10-dione bromide Openeye Name: 1,4-diamino-5-[2-(3-methyl-2H-imidazol-1-yl)ethylamino]anthracene-9,10-dione bromide CAS Name: 1,4-diamino-5-[2-(3-methyl-2H-imidazol-1-yl)ethylamino]anthracene-9,10-dione bromide IUPAC Name: 1,4-diamino-5-[2-(3-methyl-2H-imidazol-1-yl)ethylamino]anthracene-9,10-dione bromide Traditional Name: 1,4-diamino-5-[2-(3-methyl-4-imidazolin-1-yl)ethylamino]-9,10-anthraquinone bromide Formula: C20H21BrN5O2- MolecularWeight: 443.31704

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Descriptors Computed from Structure

Canonical SMILES:

CN1CN(C=C1)CCNC2=CC=CC3=C2C(=O)C4=C(C=CC(=C4C3=O)N)N.[Br-]

Isomeric SMILES

CN1CN(C=C1)CCNC2=CC=CC3=C2C(=O)C4=C(C=CC(=C4C3=O)N)N.[Br-]

InChI

InChI=1S/C20H21N5O2.BrH/c1-24-9-10-25(11-24)8-7-23-15-4-2-3-12-16(15)20(27)18-14(22)6-5-13(21)17(18)19(12)26;/h2-6,9-10,23H,7-8,11,21-22H2,1H3;1H/p-1