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

Systemtic Name: N'-[(3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-N-(4-methylphenyl)propanediamide Openeye Name: N'-[(3-bromo-5-methoxy-4-prop-2-ynoxy-phenyl)methyleneamino]-N-(p-tolyl)propanediamide CAS Name: N'-[(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]-N-(4-methylphenyl)propanediamide IUPAC Name: N'-[(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]-N-(4-methylphenyl)propanediamide Traditional Name: N'-[(3-bromo-5-methoxy-4-propargyloxy-benzylidene)amino]-N-(p-tolyl)malonamide Formula: C21H20BrN3O4 MolecularWeight: 458.3052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CC(=O)NN=CC2=CC(=C(C(=C2)Br)OCC#C)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CC(=O)NN=CC2=CC(=C(C(=C2)Br)OCC#C)OC

InChI

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