N'-[(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)methylideneamino]-N-(2,3-dimethylphenyl)butanediamide

Systemtic Name: N'-[(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)methylideneamino]-N-(2,3-dimethylphenyl)butanediamide Openeye Name: N'-[(4-benzyloxy-3-bromo-5-ethoxy-phenyl)methyleneamino]-N-(2,3-dimethylphenyl)butanediamide CAS Name: N'-[(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methylideneamino]-N-(2,3-dimethylphenyl)butanediamide IUPAC Name: N'-[(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methylideneamino]-N-(2,3-dimethylphenyl)butanediamide Traditional Name: N'-[(4-benzoxy-3-bromo-5-ethoxy-benzylidene)amino]-N-(2,3-dimethylphenyl)succinamide Formula: C28H30BrN3O4 MolecularWeight: 552.4595

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=NNC(=O)CCC(=O)NC2=CC=CC(=C2C)C)Br)OCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=NNC(=O)CCC(=O)NC2=CC=CC(=C2C)C)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C28H30BrN3O4/c1-4-35-25-16-22(15-23(29)28(25)36-18-21-10-6-5-7-11-21)17-30-32-27(34)14-13-26(33)31-24-12-8-9-19(2)20(24)3/h5-12,15-17H,4,13-14,18H2,1-3H3,(H,31,33)(H,32,34)