carboxymethyl-[3-(4-methoxyphenyl)-3-oxidanylidene-propyl]-methyl-azanium chloride

Systemtic Name: carboxymethyl-[3-(4-methoxyphenyl)-3-oxidanylidene-propyl]-methyl-azanium chloride Openeye Name: carboxymethyl-[3-(4-methoxyphenyl)-3-oxo-propyl]-methyl-ammonium chloride CAS Name: carboxymethyl-[3-(4-methoxyphenyl)-3-oxopropyl]-methylammonium chloride IUPAC Name: carboxymethyl-[3-(4-methoxyphenyl)-3-oxopropyl]-methylazanium chloride Traditional Name: carboxymethyl-[3-keto-3-(4-methoxyphenyl)propyl]-methyl-ammonium chloride Formula: C13H18ClNO4 MolecularWeight: 287.73932

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC(=O)C1=CC=C(C=C1)OC)CC(=O)O.[Cl-]

Isomeric SMILES

C[NH+](CCC(=O)C1=CC=C(C=C1)OC)CC(=O)O.[Cl-]

InChI

InChI=1S/C13H17NO4.ClH/c1-14(9-13(16)17)8-7-12(15)10-3-5-11(18-2)6-4-10;/h3-6H,7-9H2,1-2H3,(H,16,17);1H