N-(3-chloranyl-4-methyl-phenyl)-N'-[[4-(dimethylamino)-3-nitro-phenyl]methylideneamino]butanediamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-N'-[[4-(dimethylamino)-3-nitro-phenyl]methylideneamino]butanediamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-N'-[[4-(dimethylamino)-3-nitro-phenyl]methyleneamino]butanediamide CAS Name: N-(3-chloro-4-methylphenyl)-N'-[[4-(dimethylamino)-3-nitrophenyl]methylideneamino]butanediamide IUPAC Name: N-(3-chloro-4-methylphenyl)-N'-[[4-(dimethylamino)-3-nitrophenyl]methylideneamino]butanediamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-N'-[[4-(dimethylamino)-3-nitro-benzylidene]amino]succinamide Formula: C20H22ClN5O4 MolecularWeight: 431.87278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClN5O4/c1-13-4-6-15(11-16(13)21)23-19(27)8-9-20(28)24-22-12-14-5-7-17(25(2)3)18(10-14)26(29)30/h4-7,10-12H,8-9H2,1-3H3,(H,23,27)(H,24,28)