ethyl 1-[(4-methoxy-3-oxidanyl-phenyl)methyl]-3-phenethyl-piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(4-methoxy-3-oxidanyl-phenyl)methyl]-3-phenethyl-piperidine-3-carboxylate Openeye Name: ethyl 1-[(3-hydroxy-4-methoxy-phenyl)methyl]-3-phenethyl-piperidine-3-carboxylate CAS Name: 1-[(3-hydroxy-4-methoxyphenyl)methyl]-3-phenethyl-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(3-hydroxy-4-methoxyphenyl)methyl]-3-phenethylpiperidine-3-carboxylate Traditional Name: 1-(3-hydroxy-4-methoxy-benzyl)-3-phenethyl-nipecotic acid ethyl ester Formula: C24H31NO4 MolecularWeight: 397.50724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)CC2=CC(=C(C=C2)OC)O)CCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)CC2=CC(=C(C=C2)OC)O)CCC3=CC=CC=C3

InChI

InChI=1S/C24H31NO4/c1-3-29-23(27)24(14-12-19-8-5-4-6-9-19)13-7-15-25(18-24)17-20-10-11-22(28-2)21(26)16-20/h4-6,8-11,16,26H,3,7,12-15,17-18H2,1-2H3