N'-[(3-bromanyl-4-prop-2-enoxy-phenyl)methylideneamino]-N-(4-ethoxyphenyl)propanediamide

Systemtic Name: N'-[(3-bromanyl-4-prop-2-enoxy-phenyl)methylideneamino]-N-(4-ethoxyphenyl)propanediamide Openeye Name: N'-[(4-allyloxy-3-bromo-phenyl)methyleneamino]-N-(4-ethoxyphenyl)propanediamide CAS Name: N'-[(3-bromo-4-prop-2-enoxyphenyl)methylideneamino]-N-(4-ethoxyphenyl)propanediamide IUPAC Name: N'-[(3-bromo-4-prop-2-enoxyphenyl)methylideneamino]-N-(4-ethoxyphenyl)propanediamide Traditional Name: N'-[(4-allyloxy-3-bromo-benzylidene)amino]-N-p-phenetyl-malonamide Formula: C21H22BrN3O4 MolecularWeight: 460.32108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CC(=O)NN=CC2=CC(=C(C=C2)OCC=C)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CC(=O)NN=CC2=CC(=C(C=C2)OCC=C)Br

InChI

InChI=1S/C21H22BrN3O4/c1-3-11-29-19-10-5-15(12-18(19)22)14-23-25-21(27)13-20(26)24-16-6-8-17(9-7-16)28-4-2/h3,5-10,12,14H,1,4,11,13H2,2H3,(H,24,26)(H,25,27)