4-chloranyl-2-[[dimethyl(2-phenoxyethyl)azaniumyl]methyl]-5-ethanoyl-phenolate

Systemtic Name: 4-chloranyl-2-[[dimethyl(2-phenoxyethyl)azaniumyl]methyl]-5-ethanoyl-phenolate Openeye Name: 5-acetyl-4-chloro-2-[[dimethyl(2-phenoxyethyl)ammonio]methyl]phenolate CAS Name: 5-acetyl-4-chloro-2-[[dimethyl(2-phenoxyethyl)ammonio]methyl]phenolate IUPAC Name: 5-acetyl-4-chloro-2-[[dimethyl(2-phenoxyethyl)azaniumyl]methyl]phenolate Traditional Name: 5-acetyl-4-chloro-2-[[dimethyl(2-phenoxyethyl)ammonio]methyl]phenolate Formula: C19H22ClNO3 MolecularWeight: 347.83588

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1Cl)C[N+](C)(C)CCOC2=CC=CC=C2)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1Cl)C[N+](C)(C)CCOC2=CC=CC=C2)[O-]

InChI

InChI=1S/C19H22ClNO3/c1-14(22)17-12-19(23)15(11-18(17)20)13-21(2,3)9-10-24-16-7-5-4-6-8-16/h4-8,11-12H,9-10,13H2,1-3H3