1-azanyl-4-(ethylamino)-2-[4-(2-hydroxyethyl)piperazin-1-yl]anthracene-9,10-dione

Systemtic Name: 1-azanyl-4-(ethylamino)-2-[4-(2-hydroxyethyl)piperazin-1-yl]anthracene-9,10-dione Openeye Name: 1-amino-4-(ethylamino)-2-[4-(2-hydroxyethyl)piperazin-1-yl]anthracene-9,10-dione CAS Name: 1-amino-4-(ethylamino)-2-[4-(2-hydroxyethyl)-1-piperazinyl]anthracene-9,10-dione IUPAC Name: 1-amino-4-(ethylamino)-2-[4-(2-hydroxyethyl)piperazin-1-yl]anthracene-9,10-dione Traditional Name: 1-amino-4-(ethylamino)-2-[4-(2-hydroxyethyl)piperazino]-9,10-anthraquinone Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C2C(=C(C(=C1)N3CCN(CC3)CCO)N)C(=O)C4=CC=CC=C4C2=O

Isomeric SMILES

CCNC1=C2C(=C(C(=C1)N3CCN(CC3)CCO)N)C(=O)C4=CC=CC=C4C2=O

InChI

InChI=1S/C22H26N4O3/c1-2-24-16-13-17(26-9-7-25(8-10-26)11-12-27)20(23)19-18(16)21(28)14-5-3-4-6-15(14)22(19)29/h3-6,13,24,27H,2,7-12,23H2,1H3