[[(E)-3-(4-bromophenyl)-3-oxidanylidene-prop-1-enyl]-methyl-amino] 3-(trifluoromethyl)benzoate

Systemtic Name: [[(E)-3-(4-bromophenyl)-3-oxidanylidene-prop-1-enyl]-methyl-amino] 3-(trifluoromethyl)benzoate Openeye Name: [[(E)-3-(4-bromophenyl)-3-oxo-prop-1-enyl]-methyl-amino] 3-(trifluoromethyl)benzoate CAS Name: 3-(trifluoromethyl)benzoic acid [[(E)-3-(4-bromophenyl)-3-oxoprop-1-enyl]-methylamino] ester IUPAC Name: [[(E)-3-(4-bromophenyl)-3-oxoprop-1-enyl]-methylamino] 3-(trifluoromethyl)benzoate Traditional Name: 3-(trifluoromethyl)benzoic acid [[(E)-3-(4-bromophenyl)-3-keto-prop-1-enyl]-methyl-amino] ester Formula: C18H13BrF3NO3 MolecularWeight: 428.19993

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Descriptors Computed from Structure

Canonical SMILES:

CN(C=CC(=O)C1=CC=C(C=C1)Br)OC(=O)C2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CN(/C=C/C(=O)C1=CC=C(C=C1)Br)OC(=O)C2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C18H13BrF3NO3/c1-23(10-9-16(24)12-5-7-15(19)8-6-12)26-17(25)13-3-2-4-14(11-13)18(20,21)22/h2-11H,1H3/b10-9+