ethyl 4-[(4-chlorophenyl)methyl]-1-[(3,5-dimethoxy-4-oxidanyl-phenyl)methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 4-[(4-chlorophenyl)methyl]-1-[(3,5-dimethoxy-4-oxidanyl-phenyl)methyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 4-[(4-chlorophenyl)methyl]-1-[(4-hydroxy-3,5-dimethoxy-phenyl)methyl]piperidin-1-ium-4-carboxylate CAS Name: 4-[(4-chlorophenyl)methyl]-1-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-chlorophenyl)methyl]-1-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]piperidin-1-ium-4-carboxylate Traditional Name: 4-(4-chlorobenzyl)-1-(4-hydroxy-3,5-dimethoxy-benzyl)piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C24H31ClNO5+ MolecularWeight: 448.95964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC[NH+](CC1)CC2=CC(=C(C(=C2)OC)O)OC)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1(CC[NH+](CC1)CC2=CC(=C(C(=C2)OC)O)OC)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H30ClNO5/c1-4-31-23(28)24(15-17-5-7-19(25)8-6-17)9-11-26(12-10-24)16-18-13-20(29-2)22(27)21(14-18)30-3/h5-8,13-14,27H,4,9-12,15-16H2,1-3H3/p+1