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

Systemtic Name: N-(4-fluorophenyl)-N'-[(3-methoxy-2-prop-2-ynoxy-phenyl)methylideneamino]butanediamide Openeye Name: N-(4-fluorophenyl)-N'-[(3-methoxy-2-prop-2-ynoxy-phenyl)methyleneamino]butanediamide CAS Name: N-(4-fluorophenyl)-N'-[(3-methoxy-2-prop-2-ynoxyphenyl)methylideneamino]butanediamide IUPAC Name: N-(4-fluorophenyl)-N'-[(3-methoxy-2-prop-2-ynoxyphenyl)methylideneamino]butanediamide Traditional Name: N-(4-fluorophenyl)-N'-[(3-methoxy-2-propargyloxy-benzylidene)amino]succinamide Formula: C21H20FN3O4 MolecularWeight: 397.399603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20FN3O4/c1-3-13-29-21-15(5-4-6-18(21)28-2)14-23-25-20(27)12-11-19(26)24-17-9-7-16(22)8-10-17/h1,4-10,14H,11-13H2,2H3,(H,24,26)(H,25,27)