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

Systemtic Name: N'-[(3-chloranyl-5-ethoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-N-(2-methylphenyl)propanediamide Openeye Name: N'-[(3-chloro-5-ethoxy-4-prop-2-ynoxy-phenyl)methyleneamino]-N-(o-tolyl)propanediamide CAS Name: N'-[(3-chloro-5-ethoxy-4-prop-2-ynoxyphenyl)methylideneamino]-N-(2-methylphenyl)propanediamide IUPAC Name: N'-[(3-chloro-5-ethoxy-4-prop-2-ynoxyphenyl)methylideneamino]-N-(2-methylphenyl)propanediamide Traditional Name: N'-[(3-chloro-5-ethoxy-4-propargyloxy-benzylidene)amino]-N-(o-tolyl)malonamide Formula: C22H22ClN3O4 MolecularWeight: 427.88078

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=NNC(=O)CC(=O)NC2=CC=CC=C2C)Cl)OCC#C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=NNC(=O)CC(=O)NC2=CC=CC=C2C)Cl)OCC#C

InChI

InChI=1S/C22H22ClN3O4/c1-4-10-30-22-17(23)11-16(12-19(22)29-5-2)14-24-26-21(28)13-20(27)25-18-9-7-6-8-15(18)3/h1,6-9,11-12,14H,5,10,13H2,2-3H3,(H,25,27)(H,26,28)