1,5-bis[[4-(2-methylbutyl)phenyl]amino]anthracene-9,10-dione

Systemtic Name: 1,5-bis[[4-(2-methylbutyl)phenyl]amino]anthracene-9,10-dione Openeye Name: 1,5-bis[4-(2-methylbutyl)anilino]anthracene-9,10-dione CAS Name: 1,5-bis[4-(2-methylbutyl)anilino]anthracene-9,10-dione IUPAC Name: 1,5-bis[4-(2-methylbutyl)anilino]anthracene-9,10-dione Traditional Name: 1,5-bis[4-(2-methylbutyl)anilino]-9,10-anthraquinone Formula: C36H38N2O2 MolecularWeight: 530.69912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC1=CC=C(C=C1)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC5=CC=C(C=C5)CC(C)CC

Isomeric SMILES

CCC(C)CC1=CC=C(C=C1)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC5=CC=C(C=C5)CC(C)CC

InChI

InChI=1S/C36H38N2O2/c1-5-23(3)21-25-13-17-27(18-14-25)37-31-11-7-9-29-33(31)35(39)30-10-8-12-32(34(30)36(29)40)38-28-19-15-26(16-20-28)22-24(4)6-2/h7-20,23-24,37-38H,5-6,21-22H2,1-4H3