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

Systemtic Name: N'-[[3-bromanyl-4-[(2-cyanophenyl)methoxy]-5-ethoxy-phenyl]methylideneamino]-N-(2-methylphenyl)butanediamide Openeye Name: N'-[[3-bromo-4-[(2-cyanophenyl)methoxy]-5-ethoxy-phenyl]methyleneamino]-N-(o-tolyl)butanediamide CAS Name: N'-[[3-bromo-4-[(2-cyanophenyl)methoxy]-5-ethoxyphenyl]methylideneamino]-N-(2-methylphenyl)butanediamide IUPAC Name: N'-[[3-bromo-4-[(2-cyanophenyl)methoxy]-5-ethoxyphenyl]methylideneamino]-N-(2-methylphenyl)butanediamide Traditional Name: N'-[[3-bromo-4-(2-cyanobenzyl)oxy-5-ethoxy-benzylidene]amino]-N-(o-tolyl)succinamide Formula: C28H27BrN4O4 MolecularWeight: 563.44238

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=NNC(=O)CCC(=O)NC2=CC=CC=C2C)Br)OCC3=CC=CC=C3C#N

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=NNC(=O)CCC(=O)NC2=CC=CC=C2C)Br)OCC3=CC=CC=C3C#N

InChI

InChI=1S/C28H27BrN4O4/c1-3-36-25-15-20(14-23(29)28(25)37-18-22-10-6-5-9-21(22)16-30)17-31-33-27(35)13-12-26(34)32-24-11-7-4-8-19(24)2/h4-11,14-15,17H,3,12-13,18H2,1-2H3,(H,32,34)(H,33,35)