5-nitro-N1,N3-bis(phenylmethyl)-N1,N3-dipyridin-2-yl-benzene-1,3-dicarboxamide

Systemtic Name: 5-nitro-N1,N3-bis(phenylmethyl)-N1,N3-dipyridin-2-yl-benzene-1,3-dicarboxamide Openeye Name: N1,N3-dibenzyl-5-nitro-N1,N3-bis(2-pyridyl)benzene-1,3-dicarboxamide CAS Name: 5-nitro-N1,N3-bis(phenylmethyl)-N1,N3-bis(2-pyridinyl)benzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-dibenzyl-5-nitro-1-N,3-N-dipyridin-2-ylbenzene-1,3-dicarboxamide Traditional Name: N,N'-dibenzyl-5-nitro-N,N'-bis(2-pyridyl)isophthalamide Formula: C32H25N5O4 MolecularWeight: 543.572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=CC=CC=N2)C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])C(=O)N(CC4=CC=CC=C4)C5=CC=CC=N5

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=CC=CC=N2)C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])C(=O)N(CC4=CC=CC=C4)C5=CC=CC=N5

InChI

InChI=1S/C32H25N5O4/c38-31(35(29-15-7-9-17-33-29)22-24-11-3-1-4-12-24)26-19-27(21-28(20-26)37(40)41)32(39)36(30-16-8-10-18-34-30)23-25-13-5-2-6-14-25/h1-21H,22-23H2