2,4-bis[4-(dodecylamino)phenyl]benzene-1,3-dicarboxamide

Systemtic Name: 2,4-bis[4-(dodecylamino)phenyl]benzene-1,3-dicarboxamide Openeye Name: 2,4-bis[4-(dodecylamino)phenyl]benzene-1,3-dicarboxamide CAS Name: 2,4-bis[4-(dodecylamino)phenyl]benzene-1,3-dicarboxamide IUPAC Name: 2,4-bis[4-(dodecylamino)phenyl]benzene-1,3-dicarboxamide Traditional Name: 2,4-bis[4-(laurylamino)phenyl]isophthalamide Formula: C44H66N4O2 MolecularWeight: 683.02044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC1=CC=C(C=C1)C2=C(C(=C(C=C2)C(=O)N)C3=CC=C(C=C3)NCCCCCCCCCCCC)C(=O)N

Isomeric SMILES

CCCCCCCCCCCCNC1=CC=C(C=C1)C2=C(C(=C(C=C2)C(=O)N)C3=CC=C(C=C3)NCCCCCCCCCCCC)C(=O)N

InChI

InChI=1S/C44H66N4O2/c1-3-5-7-9-11-13-15-17-19-21-33-47-37-27-23-35(24-28-37)39-31-32-40(43(45)49)41(42(39)44(46)50)36-25-29-38(30-26-36)48-34-22-20-18-16-14-12-10-8-6-4-2/h23-32,47-48H,3-22,33-34H2,1-2H3,(H2,45,49)(H2,46,50)