4-(butylamino)-N-(5-chloranyl-2-methyl-phenyl)-3-nitro-benzamide

Systemtic Name: 4-(butylamino)-N-(5-chloranyl-2-methyl-phenyl)-3-nitro-benzamide Openeye Name: 4-(butylamino)-N-(5-chloro-2-methyl-phenyl)-3-nitro-benzamide CAS Name: 4-(butylamino)-N-(5-chloro-2-methylphenyl)-3-nitrobenzamide IUPAC Name: 4-(butylamino)-N-(5-chloro-2-methylphenyl)-3-nitrobenzamide Traditional Name: 4-(butylamino)-N-(5-chloro-2-methyl-phenyl)-3-nitro-benzamide Formula: C18H20ClN3O3 MolecularWeight: 361.8227

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CCCCNC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C18H20ClN3O3/c1-3-4-9-20-15-8-6-13(10-17(15)22(24)25)18(23)21-16-11-14(19)7-5-12(16)2/h5-8,10-11,20H,3-4,9H2,1-2H3,(H,21,23)