1,2,3,4-tetrakis[(4-butylphenyl)amino]anthracene-9,10-dione

Systemtic Name: 1,2,3,4-tetrakis[(4-butylphenyl)amino]anthracene-9,10-dione Openeye Name: 1,2,3,4-tetrakis(4-butylanilino)anthracene-9,10-dione CAS Name: 1,2,3,4-tetrakis(4-butylanilino)anthracene-9,10-dione IUPAC Name: 1,2,3,4-tetrakis(4-butylanilino)anthracene-9,10-dione Traditional Name: 1,2,3,4-tetrakis(4-butylanilino)-9,10-anthraquinone Formula: C54H60N4O2 MolecularWeight: 797.0798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)NC5=CC=C(C=C5)CCCC)NC6=CC=C(C=C6)CCCC)NC7=CC=C(C=C7)CCCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)NC5=CC=C(C=C5)CCCC)NC6=CC=C(C=C6)CCCC)NC7=CC=C(C=C7)CCCC

InChI

InChI=1S/C54H60N4O2/c1-5-9-15-37-21-29-41(30-22-37)55-49-47-48(54(60)46-20-14-13-19-45(46)53(47)59)50(56-42-31-23-38(24-32-42)16-10-6-2)52(58-44-35-27-40(28-36-44)18-12-8-4)51(49)57-43-33-25-39(26-34-43)17-11-7-3/h13-14,19-36,55-58H,5-12,15-18H2,1-4H3