3-azanyl-4-methoxy-N-phenyl-benzamide; 2-(trifluoromethyl)aniline

Systemtic Name: 3-azanyl-4-methoxy-N-phenyl-benzamide; 2-(trifluoromethyl)aniline Openeye Name: 3-amino-4-methoxy-N-phenyl-benzamide; 2-(trifluoromethyl)aniline CAS Name: 3-amino-4-methoxy-N-phenylbenzamide; 2-(trifluoromethyl)aniline IUPAC Name: 3-amino-4-methoxy-N-phenylbenzamide; 2-(trifluoromethyl)aniline Traditional Name: 3-amino-4-methoxy-N-phenyl-benzamide; [2-(trifluoromethyl)phenyl]amine Formula: C21H20F3N3O2 MolecularWeight: 403.39761

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2)N.C1=CC=C(C(=C1)C(F)(F)F)N

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2)N.C1=CC=C(C(=C1)C(F)(F)F)N

InChI

InChI=1S/C14H14N2O2.C7H6F3N/c1-18-13-8-7-10(9-12(13)15)14(17)16-11-5-3-2-4-6-11;8-7(9,10)5-3-1-2-4-6(5)11/h2-9H,15H2,1H3,(H,16,17);1-4H,11H2