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

Systemtic Name: N'-[(2-prop-2-ynoxyphenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]butanediamide Openeye Name: N'-[(2-prop-2-ynoxyphenyl)methyleneamino]-N-[3-(trifluoromethyl)phenyl]butanediamide CAS Name: N'-[(2-prop-2-ynoxyphenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]butanediamide IUPAC Name: N'-[(2-prop-2-ynoxyphenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]butanediamide Traditional Name: N'-[(2-propargyloxybenzylidene)amino]-N-[3-(trifluoromethyl)phenyl]succinamide Formula: C21H18F3N3O3 MolecularWeight: 417.38113

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=CC=CC=C1C=NNC(=O)CCC(=O)NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

C#CCOC1=CC=CC=C1C=NNC(=O)CCC(=O)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C21H18F3N3O3/c1-2-12-30-18-9-4-3-6-15(18)14-25-27-20(29)11-10-19(28)26-17-8-5-7-16(13-17)21(22,23)24/h1,3-9,13-14H,10-12H2,(H,26,28)(H,27,29)