(3-methoxycarbonyl-4-propoxy-phenyl)methyl-dimethyl-azanium iodide

Systemtic Name: (3-methoxycarbonyl-4-propoxy-phenyl)methyl-dimethyl-azanium iodide Openeye Name: (3-methoxycarbonyl-4-propoxy-phenyl)methyl-dimethyl-ammonium iodide CAS Name: (3-methoxycarbonyl-4-propoxyphenyl)methyl-dimethylammonium iodide IUPAC Name: (3-methoxycarbonyl-4-propoxyphenyl)methyl-dimethylazanium iodide Traditional Name: (3-carbomethoxy-4-propoxy-benzyl)-dimethyl-ammonium iodide Formula: C14H22INO3 MolecularWeight: 379.23385

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C[NH+](C)C)C(=O)OC.[I-]

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C[NH+](C)C)C(=O)OC.[I-]

InChI

InChI=1S/C14H21NO3.HI/c1-5-8-18-13-7-6-11(10-15(2)3)9-12(13)14(16)17-4;/h6-7,9H,5,8,10H2,1-4H3;1H