diethyl-[(2R)-1-[(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)amino]propan-2-yl]azanium

Systemtic Name: diethyl-[(2R)-1-[(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)amino]propan-2-yl]azanium Openeye Name: diethyl-[(1R)-1-methyl-2-(4-nitro-2-pyrrolidin-1-ylsulfonyl-anilino)ethyl]ammonium CAS Name: diethyl-[(2R)-1-[4-nitro-2-(1-pyrrolidinylsulfonyl)anilino]propan-2-yl]ammonium IUPAC Name: diethyl-[(2R)-1-(4-nitro-2-pyrrolidin-1-ylsulfonylanilino)propan-2-yl]azanium Traditional Name: diethyl-[(1R)-1-methyl-2-(4-nitro-2-pyrrolidinosulfonyl-anilino)ethyl]ammonium Formula: C17H29N4O4S+ MolecularWeight: 385.50156

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(C)CNC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCCC2

Isomeric SMILES

CC[NH+](CC)[C@H](C)CNC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCCC2

InChI

InChI=1S/C17H28N4O4S/c1-4-19(5-2)14(3)13-18-16-9-8-15(21(22)23)12-17(16)26(24,25)20-10-6-7-11-20/h8-9,12,14,18H,4-7,10-11,13H2,1-3H3/p+1/t14-/m1/s1