[(1R)-2-[(2-cyano-4-nitro-phenyl)amino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[(2-cyano-4-nitro-phenyl)amino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-(2-cyano-4-nitro-anilino)-1-(2-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-(2-cyano-4-nitroanilino)-1-thiophen-2-ylethyl]-dimethylammonium IUPAC Name: [(1R)-2-(2-cyano-4-nitroanilino)-1-thiophen-2-ylethyl]-dimethylazanium Traditional Name: [(1R)-2-(2-cyano-4-nitro-anilino)-1-(2-thienyl)ethyl]-dimethyl-ammonium Formula: C15H17N4O2S+ MolecularWeight: 317.38608

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC1=C(C=C(C=C1)[N+](=O)[O-])C#N)C2=CC=CS2

Isomeric SMILES

C[NH+](C)[C@H](CNC1=C(C=C(C=C1)[N+](=O)[O-])C#N)C2=CC=CS2

InChI

InChI=1S/C15H16N4O2S/c1-18(2)14(15-4-3-7-22-15)10-17-13-6-5-12(19(20)21)8-11(13)9-16/h3-8,14,17H,10H2,1-2H3/p+1/t14-/m1/s1