1-(methylamino)-4-[(4-octylphenyl)amino]-2-undecyl-anthracene-9,10-dione

Systemtic Name: 1-(methylamino)-4-[(4-octylphenyl)amino]-2-undecyl-anthracene-9,10-dione Openeye Name: 1-(methylamino)-4-(4-octylanilino)-2-undecyl-anthracene-9,10-dione CAS Name: 1-(methylamino)-4-(4-octylanilino)-2-undecylanthracene-9,10-dione IUPAC Name: 1-(methylamino)-4-(4-octylanilino)-2-undecylanthracene-9,10-dione Traditional Name: 1-(methylamino)-4-(4-octylanilino)-2-undecyl-9,10-anthraquinone Formula: C40H54N2O2 MolecularWeight: 594.86896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CC(=C2C(=C1NC)C(=O)C3=CC=CC=C3C2=O)NC4=CC=C(C=C4)CCCCCCCC

Isomeric SMILES

CCCCCCCCCCCC1=CC(=C2C(=C1NC)C(=O)C3=CC=CC=C3C2=O)NC4=CC=C(C=C4)CCCCCCCC

InChI

InChI=1S/C40H54N2O2/c1-4-6-8-10-12-13-14-16-18-22-31-29-35(42-32-27-25-30(26-28-32)21-17-15-11-9-7-5-2)36-37(38(31)41-3)40(44)34-24-20-19-23-33(34)39(36)43/h19-20,23-29,41-42H,4-18,21-22H2,1-3H3