N-(2-bromophenyl)-N'-[(3-chloranyl-5-ethoxy-4-prop-2-ynoxy-phenyl)methylideneamino]propanediamide

Systemtic Name: N-(2-bromophenyl)-N'-[(3-chloranyl-5-ethoxy-4-prop-2-ynoxy-phenyl)methylideneamino]propanediamide Openeye Name: N-(2-bromophenyl)-N'-[(3-chloro-5-ethoxy-4-prop-2-ynoxy-phenyl)methyleneamino]propanediamide CAS Name: N-(2-bromophenyl)-N'-[(3-chloro-5-ethoxy-4-prop-2-ynoxyphenyl)methylideneamino]propanediamide IUPAC Name: N-(2-bromophenyl)-N'-[(3-chloro-5-ethoxy-4-prop-2-ynoxyphenyl)methylideneamino]propanediamide Traditional Name: N-(2-bromophenyl)-N'-[(3-chloro-5-ethoxy-4-propargyloxy-benzylidene)amino]malonamide Formula: C21H19BrClN3O4 MolecularWeight: 492.75026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=NNC(=O)CC(=O)NC2=CC=CC=C2Br)Cl)OCC#C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=NNC(=O)CC(=O)NC2=CC=CC=C2Br)Cl)OCC#C

InChI

InChI=1S/C21H19BrClN3O4/c1-3-9-30-21-16(23)10-14(11-18(21)29-4-2)13-24-26-20(28)12-19(27)25-17-8-6-5-7-15(17)22/h1,5-8,10-11,13H,4,9,12H2,2H3,(H,25,27)(H,26,28)