1-(phenylazaniumyl)cyclohexane-1-carboxylate

Systemtic Name: 1-(phenylazaniumyl)cyclohexane-1-carboxylate Openeye Name: 1-(phenylammonio)cyclohexanecarboxylate CAS Name: 1-(phenylammonio)-1-cyclohexanecarboxylate IUPAC Name: 1-(phenylazaniumyl)cyclohexane-1-carboxylate Traditional Name: 1-(phenylammonio)cyclohexanecarboxylate Formula: C13H17NO2 MolecularWeight: 219.27958

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)[O-])[NH2+]C2=CC=CC=C2

Isomeric SMILES

C1CCC(CC1)(C(=O)[O-])[NH2+]C2=CC=CC=C2

InChI

InChI=1S/C13H17NO2/c15-12(16)13(9-5-2-6-10-13)14-11-7-3-1-4-8-11/h1,3-4,7-8,14H,2,5-6,9-10H2,(H,15,16)