N'-[(5-bromanyl-2-prop-2-ynoxy-phenyl)methylideneamino]-N-(4-ethoxyphenyl)propanediamide

Systemtic Name: N'-[(5-bromanyl-2-prop-2-ynoxy-phenyl)methylideneamino]-N-(4-ethoxyphenyl)propanediamide Openeye Name: N'-[(5-bromo-2-prop-2-ynoxy-phenyl)methyleneamino]-N-(4-ethoxyphenyl)propanediamide CAS Name: N'-[(5-bromo-2-prop-2-ynoxyphenyl)methylideneamino]-N-(4-ethoxyphenyl)propanediamide IUPAC Name: N'-[(5-bromo-2-prop-2-ynoxyphenyl)methylideneamino]-N-(4-ethoxyphenyl)propanediamide Traditional Name: N'-[(5-bromo-2-propargyloxy-benzylidene)amino]-N-p-phenetyl-malonamide Formula: C21H20BrN3O4 MolecularWeight: 458.3052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20BrN3O4/c1-3-11-29-19-10-5-16(22)12-15(19)14-23-25-21(27)13-20(26)24-17-6-8-18(9-7-17)28-4-2/h1,5-10,12,14H,4,11,13H2,2H3,(H,24,26)(H,25,27)