1,5-bis(methylamino)-2,6-bis(4-pentylphenyl)anthracene-9,10-dione

Systemtic Name: 1,5-bis(methylamino)-2,6-bis(4-pentylphenyl)anthracene-9,10-dione Openeye Name: 1,5-bis(methylamino)-2,6-bis(4-pentylphenyl)anthracene-9,10-dione CAS Name: 1,5-bis(methylamino)-2,6-bis(4-pentylphenyl)anthracene-9,10-dione IUPAC Name: 1,5-bis(methylamino)-2,6-bis(4-pentylphenyl)anthracene-9,10-dione Traditional Name: 2,6-bis(4-amylphenyl)-1,5-bis(methylamino)-9,10-anthraquinone Formula: C38H42N2O2 MolecularWeight: 558.75228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=C(C3=C(C=C2)C(=O)C4=C(C3=O)C=CC(=C4NC)C5=CC=C(C=C5)CCCCC)NC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=C(C3=C(C=C2)C(=O)C4=C(C3=O)C=CC(=C4NC)C5=CC=C(C=C5)CCCCC)NC

InChI

InChI=1S/C38H42N2O2/c1-5-7-9-11-25-13-17-27(18-14-25)29-21-23-31-33(35(29)39-3)37(41)32-24-22-30(36(40-4)34(32)38(31)42)28-19-15-26(16-20-28)12-10-8-6-2/h13-24,39-40H,5-12H2,1-4H3