4-[[[2,6-bis(chloranyl)phenyl]methylazaniumyl]methyl]cyclohexane-1-carboxylate

Systemtic Name: 4-[[[2,6-bis(chloranyl)phenyl]methylazaniumyl]methyl]cyclohexane-1-carboxylate Openeye Name: 4-[[(2,6-dichlorophenyl)methylammonio]methyl]cyclohexanecarboxylate CAS Name: 4-[[(2,6-dichlorophenyl)methylammonio]methyl]-1-cyclohexanecarboxylate IUPAC Name: 4-[[(2,6-dichlorophenyl)methylazaniumyl]methyl]cyclohexane-1-carboxylate Traditional Name: 4-[[(2,6-dichlorobenzyl)ammonio]methyl]cyclohexanecarboxylate Formula: C15H19Cl2NO2 MolecularWeight: 316.22286

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C[NH2+]CC2=C(C=CC=C2Cl)Cl)C(=O)[O-]

Isomeric SMILES

C1CC(CCC1C[NH2+]CC2=C(C=CC=C2Cl)Cl)C(=O)[O-]

InChI

InChI=1S/C15H19Cl2NO2/c16-13-2-1-3-14(17)12(13)9-18-8-10-4-6-11(7-5-10)15(19)20/h1-3,10-11,18H,4-9H2,(H,19,20)