2-[(dimethylazaniumyl)methyl]-6-[2-(4-ethylphenoxy)ethanoyl]-3-oxidanyl-phenolate

Systemtic Name: 2-[(dimethylazaniumyl)methyl]-6-[2-(4-ethylphenoxy)ethanoyl]-3-oxidanyl-phenolate Openeye Name: 2-[(dimethylammonio)methyl]-6-[2-(4-ethylphenoxy)acetyl]-3-hydroxy-phenolate CAS Name: 2-[(dimethylammonio)methyl]-6-[2-(4-ethylphenoxy)-1-oxoethyl]-3-hydroxyphenolate IUPAC Name: 2-[(dimethylazaniumyl)methyl]-6-[2-(4-ethylphenoxy)acetyl]-3-hydroxyphenolate Traditional Name: 2-[(dimethylammonio)methyl]-6-[2-(4-ethylphenoxy)acetyl]-3-hydroxy-phenolate Formula: C19H23NO4 MolecularWeight: 329.39022

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(=O)C2=C(C(=C(C=C2)O)C[NH+](C)C)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)OCC(=O)C2=C(C(=C(C=C2)O)C[NH+](C)C)[O-]

InChI

InChI=1S/C19H23NO4/c1-4-13-5-7-14(8-6-13)24-12-18(22)15-9-10-17(21)16(19(15)23)11-20(2)3/h5-10,21,23H,4,11-12H2,1-3H3