4-[(3,4-dichlorophenyl)methylamino]-N-(3-fluoranyl-4-methyl-phenyl)-3-nitro-benzamide

Systemtic Name: 4-[(3,4-dichlorophenyl)methylamino]-N-(3-fluoranyl-4-methyl-phenyl)-3-nitro-benzamide Openeye Name: 4-[(3,4-dichlorophenyl)methylamino]-N-(3-fluoro-4-methyl-phenyl)-3-nitro-benzamide CAS Name: 4-[(3,4-dichlorophenyl)methylamino]-N-(3-fluoro-4-methylphenyl)-3-nitrobenzamide IUPAC Name: 4-[(3,4-dichlorophenyl)methylamino]-N-(3-fluoro-4-methylphenyl)-3-nitrobenzamide Traditional Name: 4-[(3,4-dichlorobenzyl)amino]-N-(3-fluoro-4-methyl-phenyl)-3-nitro-benzamide Formula: C21H16Cl2FN3O3 MolecularWeight: 448.274443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)NCC3=CC(=C(C=C3)Cl)Cl)[N+](=O)[O-])F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)NCC3=CC(=C(C=C3)Cl)Cl)[N+](=O)[O-])F

InChI

InChI=1S/C21H16Cl2FN3O3/c1-12-2-5-15(10-18(12)24)26-21(28)14-4-7-19(20(9-14)27(29)30)25-11-13-3-6-16(22)17(23)8-13/h2-10,25H,11H2,1H3,(H,26,28)