3-(4-chloranylpyrazol-1-yl)-N-[(4-chlorophenyl)methyl]propanamide

Systemtic Name: 3-(4-chloranylpyrazol-1-yl)-N-[(4-chlorophenyl)methyl]propanamide Openeye Name: N-[(4-chlorophenyl)methyl]-3-(4-chloropyrazol-1-yl)propanamide CAS Name: N-[(4-chlorophenyl)methyl]-3-(4-chloro-1-pyrazolyl)propanamide IUPAC Name: N-[(4-chlorophenyl)methyl]-3-(4-chloropyrazol-1-yl)propanamide Traditional Name: N-(4-chlorobenzyl)-3-(4-chloropyrazol-1-yl)propionamide Formula: C13H13Cl2N3O MolecularWeight: 298.16782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)CCN2C=C(C=N2)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)CCN2C=C(C=N2)Cl)Cl

InChI

InChI=1S/C13H13Cl2N3O/c14-11-3-1-10(2-4-11)7-16-13(19)5-6-18-9-12(15)8-17-18/h1-4,8-9H,5-7H2,(H,16,19)