methyl 7-azanyl-1,5-bis(bromanyl)-6-oxidanyl-9,10-bis(oxidanylidene)anthracene-2-carboxylate

Systemtic Name: methyl 7-azanyl-1,5-bis(bromanyl)-6-oxidanyl-9,10-bis(oxidanylidene)anthracene-2-carboxylate Openeye Name: methyl 7-amino-1,5-dibromo-6-hydroxy-9,10-dioxo-anthracene-2-carboxylate CAS Name: 7-amino-1,5-dibromo-6-hydroxy-9,10-dioxo-2-anthracenecarboxylic acid methyl ester IUPAC Name: methyl 7-amino-1,5-dibromo-6-hydroxy-9,10-dioxoanthracene-2-carboxylate Traditional Name: 7-amino-1,5-dibromo-6-hydroxy-9,10-diketo-anthracene-2-carboxylic acid methyl ester Formula: C16H9Br2NO5 MolecularWeight: 455.05436

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(C=C1)C(=O)C3=C(C(=C(C=C3C2=O)N)O)Br)Br

Isomeric SMILES

COC(=O)C1=C(C2=C(C=C1)C(=O)C3=C(C(=C(C=C3C2=O)N)O)Br)Br

InChI

InChI=1S/C16H9Br2NO5/c1-24-16(23)6-3-2-5-9(11(6)17)14(21)7-4-8(19)15(22)12(18)10(7)13(5)20/h2-4,22H,19H2,1H3