1-nitro-4,8-bis(oxidanyl)-5-[(4-propan-2-ylphenyl)amino]anthracene-9,10-dione

Systemtic Name: 1-nitro-4,8-bis(oxidanyl)-5-[(4-propan-2-ylphenyl)amino]anthracene-9,10-dione Openeye Name: 1,5-dihydroxy-4-(4-isopropylanilino)-8-nitro-anthracene-9,10-dione CAS Name: 1,5-dihydroxy-4-nitro-8-(4-propan-2-ylanilino)anthracene-9,10-dione IUPAC Name: 1,5-dihydroxy-4-nitro-8-(4-propan-2-ylanilino)anthracene-9,10-dione Traditional Name: 1-cumidino-4,8-dihydroxy-5-nitro-9,10-anthraquinone Formula: C23H18N2O6 MolecularWeight: 418.39882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)O)[N+](=O)[O-]

InChI

InChI=1S/C23H18N2O6/c1-11(2)12-3-5-13(6-4-12)24-14-7-9-16(26)20-18(14)22(28)21-17(27)10-8-15(25(30)31)19(21)23(20)29/h3-11,24,26-27H,1-2H3