N'-[(3-methoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]butanediamide

Systemtic Name: N'-[(3-methoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]butanediamide Openeye Name: N'-[(3-methoxy-4-prop-2-ynoxy-phenyl)methyleneamino]-N-[3-(trifluoromethyl)phenyl]butanediamide CAS Name: N'-[(3-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]butanediamide IUPAC Name: N'-[(3-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]butanediamide Traditional Name: N'-[(3-methoxy-4-propargyloxy-benzylidene)amino]-N-[3-(trifluoromethyl)phenyl]succinamide Formula: C22H20F3N3O4 MolecularWeight: 447.40711

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=O)CCC(=O)NC2=CC=CC(=C2)C(F)(F)F)OCC#C

Isomeric SMILES

COC1=C(C=CC(=C1)C=NNC(=O)CCC(=O)NC2=CC=CC(=C2)C(F)(F)F)OCC#C

InChI

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