ethyl 1-[(2-chloranyl-3,4-dimethoxy-phenyl)methyl]-4-(phenylmethyl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(2-chloranyl-3,4-dimethoxy-phenyl)methyl]-4-(phenylmethyl)piperidine-4-carboxylate Openeye Name: ethyl 4-benzyl-1-[(2-chloro-3,4-dimethoxy-phenyl)methyl]piperidine-4-carboxylate CAS Name: 1-[(2-chloro-3,4-dimethoxyphenyl)methyl]-4-(phenylmethyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-benzyl-1-[(2-chloro-3,4-dimethoxyphenyl)methyl]piperidine-4-carboxylate Traditional Name: 4-benzyl-1-(2-chloro-3,4-dimethoxy-benzyl)isonipecotic acid ethyl ester Formula: C24H30ClNO4 MolecularWeight: 431.9523

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30ClNO4/c1-4-30-23(27)24(16-18-8-6-5-7-9-18)12-14-26(15-13-24)17-19-10-11-20(28-2)22(29-3)21(19)25/h5-11H,4,12-17H2,1-3H3