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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CCC(=O)NN=CC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3C#N)OC

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CCC(=O)NN=CC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3C#N)OC

InChI

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