3-[(dimethylazaniumyl)methyl]-4-methoxy-benzoate

Systemtic Name: 3-[(dimethylazaniumyl)methyl]-4-methoxy-benzoate Openeye Name: 3-[(dimethylammonio)methyl]-4-methoxy-benzoate CAS Name: 3-[(dimethylammonio)methyl]-4-methoxybenzoate IUPAC Name: 3-[(dimethylazaniumyl)methyl]-4-methoxybenzoate Traditional Name: 3-[(dimethylammonio)methyl]-4-methoxy-benzoate Formula: C11H15NO3 MolecularWeight: 209.2417

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=C(C=CC(=C1)C(=O)[O-])OC

Isomeric SMILES

C[NH+](C)CC1=C(C=CC(=C1)C(=O)[O-])OC

InChI

InChI=1S/C11H15NO3/c1-12(2)7-9-6-8(11(13)14)4-5-10(9)15-3/h4-6H,7H2,1-3H3,(H,13,14)