3-chloranyl-N-[2-(cyanomethyl)-4,5-dimethoxy-phenyl]propanamide

Systemtic Name: 3-chloranyl-N-[2-(cyanomethyl)-4,5-dimethoxy-phenyl]propanamide Openeye Name: 3-chloro-N-[2-(cyanomethyl)-4,5-dimethoxy-phenyl]propanamide CAS Name: 3-chloro-N-[2-(cyanomethyl)-4,5-dimethoxyphenyl]propanamide IUPAC Name: 3-chloro-N-[2-(cyanomethyl)-4,5-dimethoxyphenyl]propanamide Traditional Name: 3-chloro-N-[2-(cyanomethyl)-4,5-dimethoxy-phenyl]propionamide Formula: C13H15ClN2O3 MolecularWeight: 282.7228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CC#N)NC(=O)CCCl)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CC#N)NC(=O)CCCl)OC

InChI

InChI=1S/C13H15ClN2O3/c1-18-11-7-9(4-6-15)10(8-12(11)19-2)16-13(17)3-5-14/h7-8H,3-5H2,1-2H3,(H,16,17)