ethyl (3R)-3-[(2-fluorophenyl)methyl]-1-(3-methoxycarbonylphenyl)carbonyl-piperidine-3-carboxylate

Systemtic Name: ethyl (3R)-3-[(2-fluorophenyl)methyl]-1-(3-methoxycarbonylphenyl)carbonyl-piperidine-3-carboxylate Openeye Name: ethyl (3R)-3-[(2-fluorophenyl)methyl]-1-(3-methoxycarbonylbenzoyl)piperidine-3-carboxylate CAS Name: (3R)-3-[(2-fluorophenyl)methyl]-1-[(3-methoxycarbonylphenyl)-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-3-[(2-fluorophenyl)methyl]-1-(3-methoxycarbonylbenzoyl)piperidine-3-carboxylate Traditional Name: (3R)-1-(3-carbomethoxybenzoyl)-3-(2-fluorobenzyl)nipecotic acid ethyl ester Formula: C24H26FNO5 MolecularWeight: 427.465343

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)C2=CC(=CC=C2)C(=O)OC)CC3=CC=CC=C3F

Isomeric SMILES

CCOC(=O)[C@]1(CCCN(C1)C(=O)C2=CC(=CC=C2)C(=O)OC)CC3=CC=CC=C3F

InChI

InChI=1S/C24H26FNO5/c1-3-31-23(29)24(15-19-8-4-5-11-20(19)25)12-7-13-26(16-24)21(27)17-9-6-10-18(14-17)22(28)30-2/h4-6,8-11,14H,3,7,12-13,15-16H2,1-2H3/t24-/m1/s1