[(1R)-2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[(4-chloro-3-nitro-benzoyl)amino]-1-(2-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[(4-chloro-3-nitrophenyl)-oxomethyl]amino]-1-thiophen-2-ylethyl]-dimethylammonium IUPAC Name: [(1R)-2-[(4-chloro-3-nitrobenzoyl)amino]-1-thiophen-2-ylethyl]-dimethylazanium Traditional Name: [(1R)-2-[(4-chloro-3-nitro-benzoyl)amino]-1-(2-thienyl)ethyl]-dimethyl-ammonium Formula: C15H17ClN3O3S+ MolecularWeight: 354.83178

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-])C2=CC=CS2

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-])C2=CC=CS2

InChI

InChI=1S/C15H16ClN3O3S/c1-18(2)13(14-4-3-7-23-14)9-17-15(20)10-5-6-11(16)12(8-10)19(21)22/h3-8,13H,9H2,1-2H3,(H,17,20)/p+1/t13-/m1/s1