N,N-diethyl-3-[(4-nitrophenyl)sulfonimidoyl]propan-1-amine dihydrochloride

Systemtic Name: N,N-diethyl-3-[(4-nitrophenyl)sulfonimidoyl]propan-1-amine dihydrochloride Openeye Name: N,N-diethyl-3-[(4-nitrophenyl)sulfonimidoyl]propan-1-amine dihydrochloride CAS Name: N,N-diethyl-3-[(4-nitrophenyl)sulfonimidoyl]-1-propanamine dihydrochloride IUPAC Name: N,N-diethyl-3-[(4-nitrophenyl)sulfonimidoyl]propan-1-amine dihydrochloride Traditional Name: diethyl-[3-[(4-nitrophenyl)sulfonimidoyl]propyl]amine dihydrochloride Formula: C13H23Cl2N3O3S MolecularWeight: 372.31102

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCS(=N)(=O)C1=CC=C(C=C1)[N+](=O)[O-].Cl.Cl

Isomeric SMILES

CCN(CC)CCCS(=N)(=O)C1=CC=C(C=C1)[N+](=O)[O-].Cl.Cl

InChI

InChI=1S/C13H21N3O3S.2ClH/c1-3-15(4-2)10-5-11-20(14,19)13-8-6-12(7-9-13)16(17)18;;/h6-9,14H,3-5,10-11H2,1-2H3;2*1H