[4-[4-(5-nitropyridin-2-yl)piperazin-1-yl]pyrrolidin-2-yl]-pyrrolidin-1-yl-methanone trihydrochloride

Systemtic Name: [4-[4-(5-nitropyridin-2-yl)piperazin-1-yl]pyrrolidin-2-yl]-pyrrolidin-1-yl-methanone trihydrochloride Openeye Name: [4-[4-(5-nitro-2-pyridyl)piperazin-1-yl]pyrrolidin-2-yl]-pyrrolidin-1-yl-methanone trihydrochloride CAS Name: [4-[4-(5-nitro-2-pyridinyl)-1-piperazinyl]-2-pyrrolidinyl]-(1-pyrrolidinyl)methanone trihydrochloride IUPAC Name: [4-[4-(5-nitropyridin-2-yl)piperazin-1-yl]pyrrolidin-2-yl]-pyrrolidin-1-ylmethanone trihydrochloride Traditional Name: [4-[4-(5-nitro-2-pyridyl)piperazino]pyrrolidin-2-yl]-pyrrolidino-methanone trihydrochloride Formula: C18H29Cl3N6O3 MolecularWeight: 483.82026

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CC(CN2)N3CCN(CC3)C4=NC=C(C=C4)[N+](=O)[O-].Cl.Cl.Cl

Isomeric SMILES

C1CCN(C1)C(=O)C2CC(CN2)N3CCN(CC3)C4=NC=C(C=C4)[N+](=O)[O-].Cl.Cl.Cl

InChI

InChI=1S/C18H26N6O3.3ClH/c25-18(23-5-1-2-6-23)16-11-15(13-19-16)21-7-9-22(10-8-21)17-4-3-14(12-20-17)24(26)27;;;/h3-4,12,15-16,19H,1-2,5-11,13H2;3*1H