N'-[[4-(dimethylamino)-3-nitro-phenyl]methylideneamino]-N-(2,5-dimethylphenyl)butanediamide

Systemtic Name: N'-[[4-(dimethylamino)-3-nitro-phenyl]methylideneamino]-N-(2,5-dimethylphenyl)butanediamide Openeye Name: N'-[[4-(dimethylamino)-3-nitro-phenyl]methyleneamino]-N-(2,5-dimethylphenyl)butanediamide CAS Name: N'-[[4-(dimethylamino)-3-nitrophenyl]methylideneamino]-N-(2,5-dimethylphenyl)butanediamide IUPAC Name: N'-[[4-(dimethylamino)-3-nitrophenyl]methylideneamino]-N-(2,5-dimethylphenyl)butanediamide Traditional Name: N'-[[4-(dimethylamino)-3-nitro-benzylidene]amino]-N-(2,5-dimethylphenyl)succinamide Formula: C21H25N5O4 MolecularWeight: 411.4543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CCC(=O)NN=CC2=CC(=C(C=C2)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CCC(=O)NN=CC2=CC(=C(C=C2)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H25N5O4/c1-14-5-6-15(2)17(11-14)23-20(27)9-10-21(28)24-22-13-16-7-8-18(25(3)4)19(12-16)26(29)30/h5-8,11-13H,9-10H2,1-4H3,(H,23,27)(H,24,28)