N1,N3-bis[(4-methylphenyl)methyl]-5-nitro-benzene-1,3-dicarboxamide

Systemtic Name: N1,N3-bis[(4-methylphenyl)methyl]-5-nitro-benzene-1,3-dicarboxamide Openeye Name: 5-nitro-N1,N3-bis(p-tolylmethyl)benzene-1,3-dicarboxamide CAS Name: N1,N3-bis[(4-methylphenyl)methyl]-5-nitrobenzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis[(4-methylphenyl)methyl]-5-nitrobenzene-1,3-dicarboxamide Traditional Name: N,N'-bis(4-methylbenzyl)-5-nitro-isophthalamide Formula: C24H23N3O4 MolecularWeight: 417.45712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)NCC3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)NCC3=CC=C(C=C3)C

InChI

InChI=1S/C24H23N3O4/c1-16-3-7-18(8-4-16)14-25-23(28)20-11-21(13-22(12-20)27(30)31)24(29)26-15-19-9-5-17(2)6-10-19/h3-13H,14-15H2,1-2H3,(H,25,28)(H,26,29)