1-[[2,6-bis(bromanyl)-4-(2-hydroxyethyl)phenyl]amino]-4-oxidanyl-anthracene-9,10-dione

Systemtic Name: 1-[[2,6-bis(bromanyl)-4-(2-hydroxyethyl)phenyl]amino]-4-oxidanyl-anthracene-9,10-dione Openeye Name: 1-[2,6-dibromo-4-(2-hydroxyethyl)anilino]-4-hydroxy-anthracene-9,10-dione CAS Name: 1-[2,6-dibromo-4-(2-hydroxyethyl)anilino]-4-hydroxyanthracene-9,10-dione IUPAC Name: 1-[2,6-dibromo-4-(2-hydroxyethyl)anilino]-4-hydroxyanthracene-9,10-dione Traditional Name: 1-[2,6-dibromo-4-(2-hydroxyethyl)anilino]-4-hydroxy-9,10-anthraquinone Formula: C22H15Br2NO4 MolecularWeight: 517.1668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)NC4=C(C=C(C=C4Br)CCO)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)NC4=C(C=C(C=C4Br)CCO)Br

InChI

InChI=1S/C22H15Br2NO4/c23-14-9-11(7-8-26)10-15(24)20(14)25-16-5-6-17(27)19-18(16)21(28)12-3-1-2-4-13(12)22(19)29/h1-6,9-10,25-27H,7-8H2