1-[4-[(5-nitropyridin-2-yl)amino]pyrrolidin-2-yl]carbonylpyrrolidine-2-carbonitrile dihydrochloride

Systemtic Name: 1-[4-[(5-nitropyridin-2-yl)amino]pyrrolidin-2-yl]carbonylpyrrolidine-2-carbonitrile dihydrochloride Openeye Name: 1-[4-[(5-nitro-2-pyridyl)amino]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonitrile dihydrochloride CAS Name: 1-[[4-[(5-nitro-2-pyridinyl)amino]-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarbonitrile dihydrochloride IUPAC Name: 1-[4-[(5-nitropyridin-2-yl)amino]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonitrile dihydrochloride Traditional Name: 1-[4-[(5-nitro-2-pyridyl)amino]prolyl]pyrrolidine-2-carbonitrile dihydrochloride Formula: C15H20Cl2N6O3 MolecularWeight: 403.2637

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CC(CN2)NC3=NC=C(C=C3)[N+](=O)[O-])C#N.Cl.Cl

Isomeric SMILES

C1CC(N(C1)C(=O)C2CC(CN2)NC3=NC=C(C=C3)[N+](=O)[O-])C#N.Cl.Cl

InChI

InChI=1S/C15H18N6O3.2ClH/c16-7-11-2-1-5-20(11)15(22)13-6-10(8-17-13)19-14-4-3-12(9-18-14)21(23)24;;/h3-4,9-11,13,17H,1-2,5-6,8H2,(H,18,19);2*1H