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

Systemtic Name: N'-[(5-bromanyl-2-prop-2-ynoxy-phenyl)methylideneamino]-N-(4-methoxyphenyl)propanediamide Openeye Name: N'-[(5-bromo-2-prop-2-ynoxy-phenyl)methyleneamino]-N-(4-methoxyphenyl)propanediamide CAS Name: N'-[(5-bromo-2-prop-2-ynoxyphenyl)methylideneamino]-N-(4-methoxyphenyl)propanediamide IUPAC Name: N'-[(5-bromo-2-prop-2-ynoxyphenyl)methylideneamino]-N-(4-methoxyphenyl)propanediamide Traditional Name: N'-[(5-bromo-2-propargyloxy-benzylidene)amino]-N-(4-methoxyphenyl)malonamide Formula: C20H18BrN3O4 MolecularWeight: 444.27862

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CC(=O)NN=CC2=C(C=CC(=C2)Br)OCC#C

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CC(=O)NN=CC2=C(C=CC(=C2)Br)OCC#C

InChI

InChI=1S/C20H18BrN3O4/c1-3-10-28-18-9-4-15(21)11-14(18)13-22-24-20(26)12-19(25)23-16-5-7-17(27-2)8-6-16/h1,4-9,11,13H,10,12H2,2H3,(H,23,25)(H,24,26)