N1,N3-bis[2-[2-[(3-ethyl-2-oxidanyl-phenyl)methyl]-6-methyl-phenoxy]ethyl]benzene-1,3-dicarboxamide

Systemtic Name: N1,N3-bis[2-[2-[(3-ethyl-2-oxidanyl-phenyl)methyl]-6-methyl-phenoxy]ethyl]benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis[2-[2-[(3-ethyl-2-hydroxy-phenyl)methyl]-6-methyl-phenoxy]ethyl]benzene-1,3-dicarboxamide CAS Name: N1,N3-bis[2-[2-[(3-ethyl-2-hydroxyphenyl)methyl]-6-methylphenoxy]ethyl]benzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis[2-[2-[(3-ethyl-2-hydroxyphenyl)methyl]-6-methylphenoxy]ethyl]benzene-1,3-dicarboxamide Traditional Name: N,N'-bis[2-[2-(3-ethyl-2-hydroxy-benzyl)-6-methyl-phenoxy]ethyl]isophthalamide Formula: C44H48N2O6 MolecularWeight: 700.86172

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1O)CC2=CC=CC(=C2OCCNC(=O)C3=CC(=CC=C3)C(=O)NCCOC4=C(C=CC=C4CC5=C(C(=CC=C5)CC)O)C)C

Isomeric SMILES

CCC1=CC=CC(=C1O)CC2=CC=CC(=C2OCCNC(=O)C3=CC(=CC=C3)C(=O)NCCOC4=C(C=CC=C4CC5=C(C(=CC=C5)CC)O)C)C

InChI

InChI=1S/C44H48N2O6/c1-5-31-14-9-16-33(39(31)47)26-35-18-7-12-29(3)41(35)51-24-22-45-43(49)37-20-11-21-38(28-37)44(50)46-23-25-52-42-30(4)13-8-19-36(42)27-34-17-10-15-32(6-2)40(34)48/h7-21,28,47-48H,5-6,22-27H2,1-4H3,(H,45,49)(H,46,50)