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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=NNC(=O)CCC(=O)NC2=CC=CC=C2)Br)OCC3=CC=CC=C3C#N

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=NNC(=O)CCC(=O)NC2=CC=CC=C2)Br)OCC3=CC=CC=C3C#N

InChI

InChI=1S/C27H25BrN4O4/c1-2-35-24-15-19(14-23(28)27(24)36-18-21-9-7-6-8-20(21)16-29)17-30-32-26(34)13-12-25(33)31-22-10-4-3-5-11-22/h3-11,14-15,17H,2,12-13,18H2,1H3,(H,31,33)(H,32,34)