N-(2-methoxy-5-methyl-phenyl)-3-[[2-nitro-4-(trifluoromethyl)phenyl]amino]propanamide

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-3-[[2-nitro-4-(trifluoromethyl)phenyl]amino]propanamide Openeye Name: N-(2-methoxy-5-methyl-phenyl)-3-[2-nitro-4-(trifluoromethyl)anilino]propanamide CAS Name: N-(2-methoxy-5-methylphenyl)-3-[2-nitro-4-(trifluoromethyl)anilino]propanamide IUPAC Name: N-(2-methoxy-5-methylphenyl)-3-[2-nitro-4-(trifluoromethyl)anilino]propanamide Traditional Name: N-(2-methoxy-5-methyl-phenyl)-3-[2-nitro-4-(trifluoromethyl)anilino]propionamide Formula: C18H18F3N3O4 MolecularWeight: 397.34843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)CCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)CCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H18F3N3O4/c1-11-3-6-16(28-2)14(9-11)23-17(25)7-8-22-13-5-4-12(18(19,20)21)10-15(13)24(26)27/h3-6,9-10,22H,7-8H2,1-2H3,(H,23,25)