N-[2,3-bis(chloranyl)phenyl]-N'-[(3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylideneamino]propanediamide

Systemtic Name: N-[2,3-bis(chloranyl)phenyl]-N'-[(3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylideneamino]propanediamide Openeye Name: N'-[(3-bromo-5-methoxy-4-prop-2-ynoxy-phenyl)methyleneamino]-N-(2,3-dichlorophenyl)propanediamide CAS Name: N'-[(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]-N-(2,3-dichlorophenyl)propanediamide IUPAC Name: N'-[(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]-N-(2,3-dichlorophenyl)propanediamide Traditional Name: N'-[(3-bromo-5-methoxy-4-propargyloxy-benzylidene)amino]-N-(2,3-dichlorophenyl)malonamide Formula: C20H16BrCl2N3O4 MolecularWeight: 513.16874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC(=O)CC(=O)NC2=C(C(=CC=C2)Cl)Cl)Br)OCC#C

Isomeric SMILES

COC1=C(C(=CC(=C1)C=NNC(=O)CC(=O)NC2=C(C(=CC=C2)Cl)Cl)Br)OCC#C

InChI

InChI=1S/C20H16BrCl2N3O4/c1-3-7-30-20-13(21)8-12(9-16(20)29-2)11-24-26-18(28)10-17(27)25-15-6-4-5-14(22)19(15)23/h1,4-6,8-9,11H,7,10H2,2H3,(H,25,27)(H,26,28)