ethyl 4-[(4-chlorophenyl)methyl]-1-[(4-methoxy-2-oxidanyl-phenyl)methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 4-[(4-chlorophenyl)methyl]-1-[(4-methoxy-2-oxidanyl-phenyl)methyl]piperidine-4-carboxylate Openeye Name: ethyl 4-[(4-chlorophenyl)methyl]-1-[(2-hydroxy-4-methoxy-phenyl)methyl]piperidine-4-carboxylate CAS Name: 4-[(4-chlorophenyl)methyl]-1-[(2-hydroxy-4-methoxyphenyl)methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-chlorophenyl)methyl]-1-[(2-hydroxy-4-methoxyphenyl)methyl]piperidine-4-carboxylate Traditional Name: 4-(4-chlorobenzyl)-1-(2-hydroxy-4-methoxy-benzyl)isonipecotic acid ethyl ester Formula: C23H28ClNO4 MolecularWeight: 417.92572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CC2=C(C=C(C=C2)OC)O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CC2=C(C=C(C=C2)OC)O)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H28ClNO4/c1-3-29-22(27)23(15-17-4-7-19(24)8-5-17)10-12-25(13-11-23)16-18-6-9-20(28-2)14-21(18)26/h4-9,14,26H,3,10-13,15-16H2,1-2H3