2,4-bis(chloranyl)-6-[(2-methylbutan-2-ylazaniumyl)methyl]phenolate

Systemtic Name: 2,4-bis(chloranyl)-6-[(2-methylbutan-2-ylazaniumyl)methyl]phenolate Openeye Name: 2,4-dichloro-6-[(1,1-dimethylpropylammonio)methyl]phenolate CAS Name: 2,4-dichloro-6-[(2-methylbutan-2-ylammonio)methyl]phenolate IUPAC Name: 2,4-dichloro-6-[(2-methylbutan-2-ylazaniumyl)methyl]phenolate Traditional Name: 2-[(tert-amylammonio)methyl]-4,6-dichloro-phenolate Formula: C12H17Cl2NO MolecularWeight: 262.17548

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)[NH2+]CC1=CC(=CC(=C1[O-])Cl)Cl

Isomeric SMILES

CCC(C)(C)[NH2+]CC1=CC(=CC(=C1[O-])Cl)Cl

InChI

InChI=1S/C12H17Cl2NO/c1-4-12(2,3)15-7-8-5-9(13)6-10(14)11(8)16/h5-6,15-16H,4,7H2,1-3H3