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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)CCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)CCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H18F3N3O4/c1-28-14-4-2-3-12(9-14)11-23-17(25)7-8-22-15-6-5-13(18(19,20)21)10-16(15)24(26)27/h2-6,9-10,22H,7-8,11H2,1H3,(H,23,25)