N-(3-chloranyl-2-methyl-phenyl)-N'-[(E)-(4-nitrophenyl)methylideneamino]butanediamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-N'-[(E)-(4-nitrophenyl)methylideneamino]butanediamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-N'-[(E)-(4-nitrophenyl)methyleneamino]butanediamide CAS Name: N-(3-chloro-2-methylphenyl)-N'-[(E)-(4-nitrophenyl)methylideneamino]butanediamide IUPAC Name: N-(3-chloro-2-methylphenyl)-N'-[(E)-(4-nitrophenyl)methylideneamino]butanediamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-N'-[(E)-(4-nitrobenzylidene)amino]succinamide Formula: C18H17ClN4O4 MolecularWeight: 388.80498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CCC(=O)NN=CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CCC(=O)N/N=C/C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN4O4/c1-12-15(19)3-2-4-16(12)21-17(24)9-10-18(25)22-20-11-13-5-7-14(8-6-13)23(26)27/h2-8,11H,9-10H2,1H3,(H,21,24)(H,22,25)/b20-11+