(1-azanyl-2-thiophen-2-yl-ethylidene)-[2-(3,4-dimethylphenoxy)ethanoyloxy]azanium

Systemtic Name: (1-azanyl-2-thiophen-2-yl-ethylidene)-[2-(3,4-dimethylphenoxy)ethanoyloxy]azanium Openeye Name: [1-amino-2-(2-thienyl)ethylidene]-[2-(3,4-dimethylphenoxy)acetyl]oxy-ammonium CAS Name: (1-amino-2-thiophen-2-ylethylidene)-[2-(3,4-dimethylphenoxy)-1-oxoethoxy]ammonium IUPAC Name: (1-amino-2-thiophen-2-ylethylidene)-[2-(3,4-dimethylphenoxy)acetyl]oxyazanium Traditional Name: [1-amino-2-(2-thienyl)ethylidene]-[2-(3,4-dimethylphenoxy)acetyl]oxy-ammonium Formula: C16H19N2O3S+ MolecularWeight: 319.39866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O3S/c1-11-5-6-13(8-12(11)2)20-10-16(19)21-18-15(17)9-14-4-3-7-22-14/h3-8H,9-10H2,1-2H3,(H2,17,18)/p+1