1-[(2,6-dimethylphenyl)amino]-4,5,8-tris(oxidanyl)anthracene-9,10-dione

Systemtic Name: 1-[(2,6-dimethylphenyl)amino]-4,5,8-tris(oxidanyl)anthracene-9,10-dione Openeye Name: 1-(2,6-dimethylanilino)-4,5,8-trihydroxy-anthracene-9,10-dione CAS Name: 1-(2,6-dimethylanilino)-4,5,8-trihydroxyanthracene-9,10-dione IUPAC Name: 1-(2,6-dimethylanilino)-4,5,8-trihydroxyanthracene-9,10-dione Traditional Name: 1-(2,6-dimethylanilino)-4,5,8-trihydroxy-9,10-anthraquinone Formula: C22H17NO5 MolecularWeight: 375.37408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)O)O

InChI

InChI=1S/C22H17NO5/c1-10-4-3-5-11(2)20(10)23-12-6-7-13(24)17-16(12)21(27)18-14(25)8-9-15(26)19(18)22(17)28/h3-9,23-26H,1-2H3