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

Systemtic Name: N1,N3-bis(5-methylpyridin-2-yl)-5-nitro-benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis(5-methyl-2-pyridyl)-5-nitro-benzene-1,3-dicarboxamide CAS Name: N1,N3-bis(5-methyl-2-pyridinyl)-5-nitrobenzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis(5-methylpyridin-2-yl)-5-nitrobenzene-1,3-dicarboxamide Traditional Name: N,N'-bis(5-methyl-2-pyridyl)-5-nitro-isophthalamide Formula: C20H17N5O4 MolecularWeight: 391.38008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)NC3=NC=C(C=C3)C

Isomeric SMILES

CC1=CN=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)NC3=NC=C(C=C3)C

InChI

InChI=1S/C20H17N5O4/c1-12-3-5-17(21-10-12)23-19(26)14-7-15(9-16(8-14)25(28)29)20(27)24-18-6-4-13(2)11-22-18/h3-11H,1-2H3,(H,21,23,26)(H,22,24,27)