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

Systemtic Name: ethyl (3S)-3-[(2-fluorophenyl)methyl]-1-(2-methoxycarbonylphenyl)carbonyl-piperidine-3-carboxylate Openeye Name: ethyl (3S)-3-[(2-fluorophenyl)methyl]-1-(2-methoxycarbonylbenzoyl)piperidine-3-carboxylate CAS Name: (3S)-3-[(2-fluorophenyl)methyl]-1-[(2-methoxycarbonylphenyl)-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-3-[(2-fluorophenyl)methyl]-1-(2-methoxycarbonylbenzoyl)piperidine-3-carboxylate Traditional Name: (3S)-1-(2-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=C2C(=O)OC)CC3=CC=CC=C3F

Isomeric SMILES

CCOC(=O)[C@@]1(CCCN(C1)C(=O)C2=CC=CC=C2C(=O)OC)CC3=CC=CC=C3F

InChI

InChI=1S/C24H26FNO5/c1-3-31-23(29)24(15-17-9-4-7-12-20(17)25)13-8-14-26(16-24)21(27)18-10-5-6-11-19(18)22(28)30-2/h4-7,9-12H,3,8,13-16H2,1-2H3/t24-/m0/s1