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

Systemtic Name: N'-[[3-bromanyl-4-[(2-cyanophenyl)methoxy]-5-ethoxy-phenyl]methylideneamino]-N-(2-methylphenyl)propanediamide Openeye Name: N'-[[3-bromo-4-[(2-cyanophenyl)methoxy]-5-ethoxy-phenyl]methyleneamino]-N-(o-tolyl)propanediamide CAS Name: N'-[[3-bromo-4-[(2-cyanophenyl)methoxy]-5-ethoxyphenyl]methylideneamino]-N-(2-methylphenyl)propanediamide IUPAC Name: N'-[[3-bromo-4-[(2-cyanophenyl)methoxy]-5-ethoxyphenyl]methylideneamino]-N-(2-methylphenyl)propanediamide Traditional Name: N'-[[3-bromo-4-(2-cyanobenzyl)oxy-5-ethoxy-benzylidene]amino]-N-(o-tolyl)malonamide Formula: C27H25BrN4O4 MolecularWeight: 549.4158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H25BrN4O4/c1-3-35-24-13-19(12-22(28)27(24)36-17-21-10-6-5-9-20(21)15-29)16-30-32-26(34)14-25(33)31-23-11-7-4-8-18(23)2/h4-13,16H,3,14,17H2,1-2H3,(H,31,33)(H,32,34)