5-[[(2-chlorophenyl)methyl-cyclohexyl-azaniumyl]methyl]furan-2-carboxylate

Systemtic Name: 5-[[(2-chlorophenyl)methyl-cyclohexyl-azaniumyl]methyl]furan-2-carboxylate Openeye Name: 5-[[(2-chlorophenyl)methyl-cyclohexyl-ammonio]methyl]furan-2-carboxylate CAS Name: 5-[[(2-chlorophenyl)methyl-cyclohexylammonio]methyl]-2-furancarboxylate IUPAC Name: 5-[[(2-chlorophenyl)methyl-cyclohexylazaniumyl]methyl]furan-2-carboxylate Traditional Name: 5-[[(2-chlorobenzyl)-cyclohexyl-ammonio]methyl]-2-furoate Formula: C19H22ClNO3 MolecularWeight: 347.83588

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+](CC2=CC=CC=C2Cl)CC3=CC=C(O3)C(=O)[O-]

Isomeric SMILES

C1CCC(CC1)[NH+](CC2=CC=CC=C2Cl)CC3=CC=C(O3)C(=O)[O-]

InChI

InChI=1S/C19H22ClNO3/c20-17-9-5-4-6-14(17)12-21(15-7-2-1-3-8-15)13-16-10-11-18(24-16)19(22)23/h4-6,9-11,15H,1-3,7-8,12-13H2,(H,22,23)