3-chloranyl-N-(phenylmethyl)propanamide dihydrate hydrochloride

Systemtic Name: 3-chloranyl-N-(phenylmethyl)propanamide dihydrate hydrochloride Openeye Name: N-benzyl-3-chloro-propanamide dihydrate hydrochloride CAS Name: 3-chloro-N-(phenylmethyl)propanamide dihydrate hydrochloride IUPAC Name: N-benzyl-3-chloropropanamide dihydrate hydrochloride Traditional Name: N-benzyl-3-chloro-propionamide dihydrate hydrochloride Formula: C10H17Cl2NO3 MolecularWeight: 270.15288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CCCl.O.O.Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CCCl.O.O.Cl

InChI

InChI=1S/C10H12ClNO.ClH.2H2O/c11-7-6-10(13)12-8-9-4-2-1-3-5-9;;;/h1-5H,6-8H2,(H,12,13);1H;2*1H2