5-nitro-N1,N3-bis[2-(2-phenylphenoxy)ethyl]benzene-1,3-dicarboxamide

Systemtic Name: 5-nitro-N1,N3-bis[2-(2-phenylphenoxy)ethyl]benzene-1,3-dicarboxamide Openeye Name: 5-nitro-N1,N3-bis[2-(2-phenylphenoxy)ethyl]benzene-1,3-dicarboxamide CAS Name: 5-nitro-N1,N3-bis[2-(2-phenylphenoxy)ethyl]benzene-1,3-dicarboxamide IUPAC Name: 5-nitro-1-N,3-N-bis[2-(2-phenylphenoxy)ethyl]benzene-1,3-dicarboxamide Traditional Name: 5-nitro-N,N'-bis[2-(2-phenylphenoxy)ethyl]isophthalamide Formula: C36H31N3O6 MolecularWeight: 601.64784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CC=C2OCCNC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])C(=O)NCCOC4=CC=CC=C4C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2OCCNC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])C(=O)NCCOC4=CC=CC=C4C5=CC=CC=C5

InChI

InChI=1S/C36H31N3O6/c40-35(37-19-21-44-33-17-9-7-15-31(33)26-11-3-1-4-12-26)28-23-29(25-30(24-28)39(42)43)36(41)38-20-22-45-34-18-10-8-16-32(34)27-13-5-2-6-14-27/h1-18,23-25H,19-22H2,(H,37,40)(H,38,41)