3-chloranyl-N-[2-cyanoethyl(phenyl)carbamoyl]propanamide

Systemtic Name: 3-chloranyl-N-[2-cyanoethyl(phenyl)carbamoyl]propanamide Openeye Name: 3-chloro-N-[2-cyanoethyl(phenyl)carbamoyl]propanamide CAS Name: 3-chloro-N-[[N-(2-cyanoethyl)anilino]-oxomethyl]propanamide IUPAC Name: 3-chloro-N-[2-cyanoethyl(phenyl)carbamoyl]propanamide Traditional Name: 3-chloro-N-[2-cyanoethyl(phenyl)carbamoyl]propionamide Formula: C13H14ClN3O2 MolecularWeight: 279.72216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCC#N)C(=O)NC(=O)CCCl

Isomeric SMILES

C1=CC=C(C=C1)N(CCC#N)C(=O)NC(=O)CCCl

InChI

InChI=1S/C13H14ClN3O2/c14-8-7-12(18)16-13(19)17(10-4-9-15)11-5-2-1-3-6-11/h1-3,5-6H,4,7-8,10H2,(H,16,18,19)