ethyl 1-[[3-(3-fluorophenyl)-4-methanoyl-pyrrolidin-1-yl]methyl]cyclohexane-1-carboxylate

Systemtic Name: ethyl 1-[[3-(3-fluorophenyl)-4-methanoyl-pyrrolidin-1-yl]methyl]cyclohexane-1-carboxylate Openeye Name: ethyl 1-[[3-(3-fluorophenyl)-4-formyl-pyrrolidin-1-yl]methyl]cyclohexanecarboxylate CAS Name: 1-[[3-(3-fluorophenyl)-4-formyl-1-pyrrolidinyl]methyl]-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[3-(3-fluorophenyl)-4-formylpyrrolidin-1-yl]methyl]cyclohexane-1-carboxylate Traditional Name: 1-[[3-(3-fluorophenyl)-4-formyl-pyrrolidino]methyl]cyclohexanecarboxylic acid ethyl ester Formula: C21H28FNO3 MolecularWeight: 361.450323

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCCC1)CN2CC(C(C2)C3=CC(=CC=C3)F)C=O

Isomeric SMILES

CCOC(=O)C1(CCCCC1)CN2CC(C(C2)C3=CC(=CC=C3)F)C=O

InChI

InChI=1S/C21H28FNO3/c1-2-26-20(25)21(9-4-3-5-10-21)15-23-12-17(14-24)19(13-23)16-7-6-8-18(22)11-16/h6-8,11,14,17,19H,2-5,9-10,12-13,15H2,1H3