ethyl 1-[(2-chloranyl-5-methoxy-4-oxidanyl-phenyl)methyl]-4-(phenylmethyl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(2-chloranyl-5-methoxy-4-oxidanyl-phenyl)methyl]-4-(phenylmethyl)piperidine-4-carboxylate Openeye Name: ethyl 4-benzyl-1-[(2-chloro-4-hydroxy-5-methoxy-phenyl)methyl]piperidine-4-carboxylate CAS Name: 1-[(2-chloro-4-hydroxy-5-methoxyphenyl)methyl]-4-(phenylmethyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-benzyl-1-[(2-chloro-4-hydroxy-5-methoxyphenyl)methyl]piperidine-4-carboxylate Traditional Name: 4-benzyl-1-(2-chloro-4-hydroxy-5-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=CC(=C(C=C2Cl)O)OC)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CC2=CC(=C(C=C2Cl)O)OC)CC3=CC=CC=C3

InChI

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