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

Systemtic Name: N-(2-nitrophenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide dihydrochloride Openeye Name: N-(2-nitrophenyl)-3-[4-(2-pyridyl)piperazin-1-yl]propanamide dihydrochloride CAS Name: N-(2-nitrophenyl)-3-[4-(2-pyridinyl)-1-piperazinyl]propanamide dihydrochloride IUPAC Name: N-(2-nitrophenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide dihydrochloride Traditional Name: N-(2-nitrophenyl)-3-[4-(2-pyridyl)piperazino]propionamide dihydrochloride Formula: C18H23Cl2N5O3 MolecularWeight: 428.31292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NC2=CC=CC=C2[N+](=O)[O-])C3=CC=CC=N3.Cl.Cl

Isomeric SMILES

C1CN(CCN1CCC(=O)NC2=CC=CC=C2[N+](=O)[O-])C3=CC=CC=N3.Cl.Cl

InChI

InChI=1S/C18H21N5O3.2ClH/c24-18(20-15-5-1-2-6-16(15)23(25)26)8-10-21-11-13-22(14-12-21)17-7-3-4-9-19-17;;/h1-7,9H,8,10-14H2,(H,20,24);2*1H