(1-azanyl-2-thiophen-2-yl-ethylidene)-(4-methyl-3-nitro-phenyl)carbonyloxy-azanium

Systemtic Name: (1-azanyl-2-thiophen-2-yl-ethylidene)-(4-methyl-3-nitro-phenyl)carbonyloxy-azanium Openeye Name: [1-amino-2-(2-thienyl)ethylidene]-(4-methyl-3-nitro-benzoyl)oxy-ammonium CAS Name: (1-amino-2-thiophen-2-ylethylidene)-[(4-methyl-3-nitrophenyl)-oxomethoxy]ammonium IUPAC Name: (1-amino-2-thiophen-2-ylethylidene)-(4-methyl-3-nitrobenzoyl)oxyazanium Traditional Name: [1-amino-2-(2-thienyl)ethylidene]-(4-methyl-3-nitro-benzoyl)oxy-ammonium Formula: C14H14N3O4S+ MolecularWeight: 320.34366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O[NH+]=C(CC2=CC=CS2)N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O[NH+]=C(CC2=CC=CS2)N)[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O4S/c1-9-4-5-10(7-12(9)17(19)20)14(18)21-16-13(15)8-11-3-2-6-22-11/h2-7H,8H2,1H3,(H2,15,16)/p+1