N'-[(3-methoxy-2-prop-2-ynoxy-phenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]butanediamide

Systemtic Name: N'-[(3-methoxy-2-prop-2-ynoxy-phenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]butanediamide Openeye Name: N'-[(3-methoxy-2-prop-2-ynoxy-phenyl)methyleneamino]-N-[3-(trifluoromethyl)phenyl]butanediamide CAS Name: N'-[(3-methoxy-2-prop-2-ynoxyphenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]butanediamide IUPAC Name: N'-[(3-methoxy-2-prop-2-ynoxyphenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]butanediamide Traditional Name: N'-[(3-methoxy-2-propargyloxy-benzylidene)amino]-N-[3-(trifluoromethyl)phenyl]succinamide Formula: C22H20F3N3O4 MolecularWeight: 447.40711

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCC#C)C=NNC(=O)CCC(=O)NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

COC1=CC=CC(=C1OCC#C)C=NNC(=O)CCC(=O)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C22H20F3N3O4/c1-3-12-32-21-15(6-4-9-18(21)31-2)14-26-28-20(30)11-10-19(29)27-17-8-5-7-16(13-17)22(23,24)25/h1,4-9,13-14H,10-12H2,2H3,(H,27,29)(H,28,30)