ethyl 3-[(2-fluorophenyl)methyl]-1-quinoxalin-6-ylcarbonyl-piperidine-3-carboxylate

Systemtic Name: ethyl 3-[(2-fluorophenyl)methyl]-1-quinoxalin-6-ylcarbonyl-piperidine-3-carboxylate Openeye Name: ethyl 3-[(2-fluorophenyl)methyl]-1-(quinoxaline-6-carbonyl)piperidine-3-carboxylate CAS Name: 3-[(2-fluorophenyl)methyl]-1-[oxo(6-quinoxalinyl)methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(2-fluorophenyl)methyl]-1-(quinoxaline-6-carbonyl)piperidine-3-carboxylate Traditional Name: 3-(2-fluorobenzyl)-1-(quinoxaline-6-carbonyl)nipecotic acid ethyl ester Formula: C24H24FN3O3 MolecularWeight: 421.464063

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)C2=CC3=NC=CN=C3C=C2)CC4=CC=CC=C4F

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)C(=O)C2=CC3=NC=CN=C3C=C2)CC4=CC=CC=C4F

InChI

InChI=1S/C24H24FN3O3/c1-2-31-23(30)24(15-18-6-3-4-7-19(18)25)10-5-13-28(16-24)22(29)17-8-9-20-21(14-17)27-12-11-26-20/h3-4,6-9,11-12,14H,2,5,10,13,15-16H2,1H3