N'-[[3-bromanyl-4-[(4-cyanophenyl)methoxy]-5-methoxy-phenyl]methylideneamino]-N-(2-fluorophenyl)butanediamide

Systemtic Name: N'-[[3-bromanyl-4-[(4-cyanophenyl)methoxy]-5-methoxy-phenyl]methylideneamino]-N-(2-fluorophenyl)butanediamide Openeye Name: N'-[[3-bromo-4-[(4-cyanophenyl)methoxy]-5-methoxy-phenyl]methyleneamino]-N-(2-fluorophenyl)butanediamide CAS Name: N'-[[3-bromo-4-[(4-cyanophenyl)methoxy]-5-methoxyphenyl]methylideneamino]-N-(2-fluorophenyl)butanediamide IUPAC Name: N'-[[3-bromo-4-[(4-cyanophenyl)methoxy]-5-methoxyphenyl]methylideneamino]-N-(2-fluorophenyl)butanediamide Traditional Name: N'-[[3-bromo-4-(4-cyanobenzyl)oxy-5-methoxy-benzylidene]amino]-N-(2-fluorophenyl)succinamide Formula: C26H22BrFN4O4 MolecularWeight: 553.379683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC(=O)CCC(=O)NC2=CC=CC=C2F)Br)OCC3=CC=C(C=C3)C#N

Isomeric SMILES

COC1=C(C(=CC(=C1)C=NNC(=O)CCC(=O)NC2=CC=CC=C2F)Br)OCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C26H22BrFN4O4/c1-35-23-13-19(12-20(27)26(23)36-16-18-8-6-17(14-29)7-9-18)15-30-32-25(34)11-10-24(33)31-22-5-3-2-4-21(22)28/h2-9,12-13,15H,10-11,16H2,1H3,(H,31,33)(H,32,34)