1-azanyl-4-[(4-methylphenyl)amino]-2-(2-methylpropylamino)anthracene-9,10-dione

Systemtic Name: 1-azanyl-4-[(4-methylphenyl)amino]-2-(2-methylpropylamino)anthracene-9,10-dione Openeye Name: 1-amino-2-(isobutylamino)-4-(4-methylanilino)anthracene-9,10-dione CAS Name: 1-amino-4-(4-methylanilino)-2-(2-methylpropylamino)anthracene-9,10-dione IUPAC Name: 1-amino-4-(4-methylanilino)-2-(2-methylpropylamino)anthracene-9,10-dione Traditional Name: 1-amino-2-(isobutylamino)-4-(p-toluidino)-9,10-anthraquinone Formula: C25H25N3O2 MolecularWeight: 399.4849

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)NCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)NCC(C)C

InChI

InChI=1S/C25H25N3O2/c1-14(2)13-27-20-12-19(28-16-10-8-15(3)9-11-16)21-22(23(20)26)25(30)18-7-5-4-6-17(18)24(21)29/h4-12,14,27-28H,13,26H2,1-3H3