N-(2-chlorophenyl)-N'-[(3-iodanyl-5-methoxy-4-prop-2-enoxy-phenyl)methylideneamino]butanediamide

Systemtic Name: N-(2-chlorophenyl)-N'-[(3-iodanyl-5-methoxy-4-prop-2-enoxy-phenyl)methylideneamino]butanediamide Openeye Name: N'-[(4-allyloxy-3-iodo-5-methoxy-phenyl)methyleneamino]-N-(2-chlorophenyl)butanediamide CAS Name: N-(2-chlorophenyl)-N'-[(3-iodo-5-methoxy-4-prop-2-enoxyphenyl)methylideneamino]butanediamide IUPAC Name: N-(2-chlorophenyl)-N'-[(3-iodo-5-methoxy-4-prop-2-enoxyphenyl)methylideneamino]butanediamide Traditional Name: N'-[(4-allyloxy-3-iodo-5-methoxy-benzylidene)amino]-N-(2-chlorophenyl)succinamide Formula: C21H21ClIN3O4 MolecularWeight: 541.76661

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC(=O)CCC(=O)NC2=CC=CC=C2Cl)I)OCC=C

Isomeric SMILES

COC1=C(C(=CC(=C1)C=NNC(=O)CCC(=O)NC2=CC=CC=C2Cl)I)OCC=C

InChI

InChI=1S/C21H21ClIN3O4/c1-3-10-30-21-16(23)11-14(12-18(21)29-2)13-24-26-20(28)9-8-19(27)25-17-7-5-4-6-15(17)22/h3-7,11-13H,1,8-10H2,2H3,(H,25,27)(H,26,28)