5-nitro-N1,N3-bis(propan-2-ylideneamino)benzene-1,3-dicarboxamide

Systemtic Name: 5-nitro-N1,N3-bis(propan-2-ylideneamino)benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis(isopropylideneamino)-5-nitro-benzene-1,3-dicarboxamide CAS Name: 5-nitro-N1,N3-bis(propan-2-ylideneamino)benzene-1,3-dicarboxamide IUPAC Name: 5-nitro-1-N,3-N-bis(propan-2-ylideneamino)benzene-1,3-dicarboxamide Traditional Name: N,N'-bis(isopropylideneamino)-5-nitro-isophthalamide Formula: C14H17N5O4 MolecularWeight: 319.31588

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NN=C(C)C)C

Isomeric SMILES

CC(=NNC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NN=C(C)C)C

InChI

InChI=1S/C14H17N5O4/c1-8(2)15-17-13(20)10-5-11(7-12(6-10)19(22)23)14(21)18-16-9(3)4/h5-7H,1-4H3,(H,17,20)(H,18,21)