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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CCC(=O)NN=CC2=CC(=C(C=C2)OCC3=CC=CC=C3C#N)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CCC(=O)NN=CC2=CC(=C(C=C2)OCC3=CC=CC=C3C#N)Br

InChI

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