1-azaniumyl-4-(4-chlorophenyl)cyclohexane-1-carboxylate

Systemtic Name: 1-azaniumyl-4-(4-chlorophenyl)cyclohexane-1-carboxylate Openeye Name: 1-azaniumyl-4-(4-chlorophenyl)cyclohexanecarboxylate CAS Name: 1-ammonio-4-(4-chlorophenyl)-1-cyclohexanecarboxylate IUPAC Name: 1-azaniumyl-4-(4-chlorophenyl)cyclohexane-1-carboxylate Traditional Name: 1-ammonio-4-(4-chlorophenyl)cyclohexanecarboxylate Formula: C13H16ClNO2 MolecularWeight: 253.72464

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2=CC=C(C=C2)Cl)(C(=O)[O-])[NH3+]

Isomeric SMILES

C1CC(CCC1C2=CC=C(C=C2)Cl)(C(=O)[O-])[NH3+]

InChI

InChI=1S/C13H16ClNO2/c14-11-3-1-9(2-4-11)10-5-7-13(15,8-6-10)12(16)17/h1-4,10H,5-8,15H2,(H,16,17)