N-[(E)-(4-chloranyl-3-nitro-phenyl)methylideneamino]-4-(3-methylbutanoylamino)benzamide

Systemtic Name: N-[(E)-(4-chloranyl-3-nitro-phenyl)methylideneamino]-4-(3-methylbutanoylamino)benzamide Openeye Name: N-[(E)-(4-chloro-3-nitro-phenyl)methyleneamino]-4-(3-methylbutanoylamino)benzamide CAS Name: N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]-4-[(3-methyl-1-oxobutyl)amino]benzamide IUPAC Name: N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]-4-(3-methylbutanoylamino)benzamide Traditional Name: N-[(E)-(4-chloro-3-nitro-benzylidene)amino]-4-(isovalerylamino)benzamide Formula: C19H19ClN4O4 MolecularWeight: 402.83156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)NN=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)N/N=C/C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H19ClN4O4/c1-12(2)9-18(25)22-15-6-4-14(5-7-15)19(26)23-21-11-13-3-8-16(20)17(10-13)24(27)28/h3-8,10-12H,9H2,1-2H3,(H,22,25)(H,23,26)/b21-11+