(2-chloranyl-5-nitro-phenyl)methyl-methyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]azanium

Systemtic Name: (2-chloranyl-5-nitro-phenyl)methyl-methyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]azanium Openeye Name: (2-chloro-5-nitro-phenyl)methyl-methyl-[2-oxo-2-(2-thienylmethylamino)ethyl]ammonium CAS Name: (2-chloro-5-nitrophenyl)methyl-methyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]ammonium IUPAC Name: (2-chloro-5-nitrophenyl)methyl-methyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]azanium Traditional Name: (2-chloro-5-nitro-benzyl)-[2-keto-2-(2-thenylamino)ethyl]-methyl-ammonium Formula: C15H17ClN3O3S+ MolecularWeight: 354.83178

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)CC(=O)NCC2=CC=CS2

Isomeric SMILES

C[NH+](CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)CC(=O)NCC2=CC=CS2

InChI

InChI=1S/C15H16ClN3O3S/c1-18(10-15(20)17-8-13-3-2-6-23-13)9-11-7-12(19(21)22)4-5-14(11)16/h2-7H,8-10H2,1H3,(H,17,20)/p+1