2-[4-(2-azanyl-3-oxidanylidene-3-pyrrolidin-1-yl-propyl)phenyl]-1-nitro-guanidine hydrochloride

Systemtic Name: 2-[4-(2-azanyl-3-oxidanylidene-3-pyrrolidin-1-yl-propyl)phenyl]-1-nitro-guanidine hydrochloride Openeye Name: 2-[4-(2-amino-3-oxo-3-pyrrolidin-1-yl-propyl)phenyl]-1-nitro-guanidine hydrochloride CAS Name: 2-[4-[2-amino-3-oxo-3-(1-pyrrolidinyl)propyl]phenyl]-1-nitroguanidine hydrochloride IUPAC Name: 2-[4-(2-amino-3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]-1-nitroguanidine hydrochloride Traditional Name: 2-[4-(2-amino-3-keto-3-pyrrolidino-propyl)phenyl]-1-nitro-guanidine hydrochloride Formula: C14H21ClN6O3 MolecularWeight: 356.80794

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(CC2=CC=C(C=C2)N=C(N)N[N+](=O)[O-])N.Cl

Isomeric SMILES

C1CCN(C1)C(=O)C(CC2=CC=C(C=C2)N=C(N)N[N+](=O)[O-])N.Cl

InChI

InChI=1S/C14H20N6O3.ClH/c15-12(13(21)19-7-1-2-8-19)9-10-3-5-11(6-4-10)17-14(16)18-20(22)23;/h3-6,12H,1-2,7-9,15H2,(H3,16,17,18);1H