4-[[[4-(diethylamino)phenyl]methylazaniumyl]methyl]cyclohexane-1-carboxylate

Systemtic Name: 4-[[[4-(diethylamino)phenyl]methylazaniumyl]methyl]cyclohexane-1-carboxylate Openeye Name: 4-[[[4-(diethylamino)phenyl]methylammonio]methyl]cyclohexanecarboxylate CAS Name: 4-[[[4-(diethylamino)phenyl]methylammonio]methyl]-1-cyclohexanecarboxylate IUPAC Name: 4-[[[4-(diethylamino)phenyl]methylazaniumyl]methyl]cyclohexane-1-carboxylate Traditional Name: 4-[[[4-(diethylamino)benzyl]ammonio]methyl]cyclohexanecarboxylate Formula: C19H30N2O2 MolecularWeight: 318.4537

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C[NH2+]CC2CCC(CC2)C(=O)[O-]

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C[NH2+]CC2CCC(CC2)C(=O)[O-]

InChI

InChI=1S/C19H30N2O2/c1-3-21(4-2)18-11-7-16(8-12-18)14-20-13-15-5-9-17(10-6-15)19(22)23/h7-8,11-12,15,17,20H,3-6,9-10,13-14H2,1-2H3,(H,22,23)