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

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-4-(3-methoxypropylamino)-3-nitro-benzamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-4-(3-methoxypropylamino)-3-nitro-benzamide CAS Name: N-(5-chloro-2-methylphenyl)-4-(3-methoxypropylamino)-3-nitrobenzamide IUPAC Name: N-(5-chloro-2-methylphenyl)-4-(3-methoxypropylamino)-3-nitrobenzamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-4-(3-methoxypropylamino)-3-nitro-benzamide Formula: C18H20ClN3O4 MolecularWeight: 377.8221

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClN3O4/c1-12-4-6-14(19)11-16(12)21-18(23)13-5-7-15(17(10-13)22(24)25)20-8-3-9-26-2/h4-7,10-11,20H,3,8-9H2,1-2H3,(H,21,23)