1-azanyl-2-[3-[di(pentan-2-yl)amino]phenoxy]-4-oxidanyl-anthracene-9,10-dione

Systemtic Name: 1-azanyl-2-[3-[di(pentan-2-yl)amino]phenoxy]-4-oxidanyl-anthracene-9,10-dione Openeye Name: 1-amino-2-[3-[bis(1-methylbutyl)amino]phenoxy]-4-hydroxy-anthracene-9,10-dione CAS Name: 1-amino-2-[3-[di(pentan-2-yl)amino]phenoxy]-4-hydroxyanthracene-9,10-dione IUPAC Name: 1-amino-2-[3-[di(pentan-2-yl)amino]phenoxy]-4-hydroxyanthracene-9,10-dione Traditional Name: 1-amino-2-[3-[bis(1-methylbutyl)amino]phenoxy]-4-hydroxy-9,10-anthraquinone Formula: C30H34N2O4 MolecularWeight: 486.60196

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)N(C1=CC(=CC=C1)OC2=C(C3=C(C(=C2)O)C(=O)C4=CC=CC=C4C3=O)N)C(C)CCC

Isomeric SMILES

CCCC(C)N(C1=CC(=CC=C1)OC2=C(C3=C(C(=C2)O)C(=O)C4=CC=CC=C4C3=O)N)C(C)CCC

InChI

InChI=1S/C30H34N2O4/c1-5-10-18(3)32(19(4)11-6-2)20-12-9-13-21(16-20)36-25-17-24(33)26-27(28(25)31)30(35)23-15-8-7-14-22(23)29(26)34/h7-9,12-19,33H,5-6,10-11,31H2,1-4H3