[(1R)-2-[(2-methoxy-5-nitro-phenyl)carbonylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[(2-methoxy-5-nitro-phenyl)carbonylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[(2-methoxy-5-nitro-benzoyl)amino]-1-(3-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[(2-methoxy-5-nitrophenyl)-oxomethyl]amino]-1-(3-thiophenyl)ethyl]-dimethylammonium IUPAC Name: [(1R)-2-[(2-methoxy-5-nitrobenzoyl)amino]-1-thiophen-3-ylethyl]-dimethylazanium Traditional Name: [(1R)-2-[(2-methoxy-5-nitro-benzoyl)amino]-1-(3-thienyl)ethyl]-dimethyl-ammonium Formula: C16H20N3O4S+ MolecularWeight: 350.4127

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])OC)C2=CSC=C2

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O4S/c1-18(2)14(11-6-7-24-10-11)9-17-16(20)13-8-12(19(21)22)4-5-15(13)23-3/h4-8,10,14H,9H2,1-3H3,(H,17,20)/p+1/t14-/m0/s1