N1,N3-bis[4-[2,4-bis(2-methylbutan-2-yl)phenyl]butyl]-5-methyl-benzene-1,3-dicarboxamide

Systemtic Name: N1,N3-bis[4-[2,4-bis(2-methylbutan-2-yl)phenyl]butyl]-5-methyl-benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis[4-[2,4-bis(1,1-dimethylpropyl)phenyl]butyl]-5-methyl-benzene-1,3-dicarboxamide CAS Name: N1,N3-bis[4-[2,4-bis(2-methylbutan-2-yl)phenyl]butyl]-5-methylbenzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis[4-[2,4-bis(2-methylbutan-2-yl)phenyl]butyl]-5-methylbenzene-1,3-dicarboxamide Traditional Name: N,N'-bis[4-(2,4-ditert-amylphenyl)butyl]-5-methyl-isophthalamide Formula: C49H74N2O2 MolecularWeight: 723.12406

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)CCCCNC(=O)C2=CC(=CC(=C2)C)C(=O)NCCCCC3=C(C=C(C=C3)C(C)(C)CC)C(C)(C)CC)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)CCCCNC(=O)C2=CC(=CC(=C2)C)C(=O)NCCCCC3=C(C=C(C=C3)C(C)(C)CC)C(C)(C)CC)C(C)(C)CC

InChI

InChI=1S/C49H74N2O2/c1-14-46(6,7)40-26-24-36(42(33-40)48(10,11)16-3)22-18-20-28-50-44(52)38-30-35(5)31-39(32-38)45(53)51-29-21-19-23-37-25-27-41(47(8,9)15-2)34-43(37)49(12,13)17-4/h24-27,30-34H,14-23,28-29H2,1-13H3,(H,50,52)(H,51,53)