N-(2-chlorophenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide hydrate dihydrochloride

Systemtic Name: N-(2-chlorophenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide hydrate dihydrochloride Openeye Name: N-(2-chlorophenyl)-3-[4-(2-pyridyl)piperazin-1-yl]propanamide hydrate dihydrochloride CAS Name: N-(2-chlorophenyl)-3-[4-(2-pyridinyl)-1-piperazinyl]propanamide hydrate dihydrochloride IUPAC Name: N-(2-chlorophenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide hydrate dihydrochloride Traditional Name: N-(2-chlorophenyl)-3-[4-(2-pyridyl)piperazino]propionamide hydrate dihydrochloride Formula: C18H25Cl3N4O2 MolecularWeight: 435.7757

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NC2=CC=CC=C2Cl)C3=CC=CC=N3.O.Cl.Cl

Isomeric SMILES

C1CN(CCN1CCC(=O)NC2=CC=CC=C2Cl)C3=CC=CC=N3.O.Cl.Cl

InChI

InChI=1S/C18H21ClN4O.2ClH.H2O/c19-15-5-1-2-6-16(15)21-18(24)8-10-22-11-13-23(14-12-22)17-7-3-4-9-20-17;;;/h1-7,9H,8,10-14H2,(H,21,24);2*1H;1H2