ethyl 4-[[[2-(3-fluorophenyl)pyrrolidin-1-yl]carbonylamino]methyl]cyclohexane-1-carboxylate

Systemtic Name: ethyl 4-[[[2-(3-fluorophenyl)pyrrolidin-1-yl]carbonylamino]methyl]cyclohexane-1-carboxylate Openeye Name: ethyl 4-[[[2-(3-fluorophenyl)pyrrolidine-1-carbonyl]amino]methyl]cyclohexanecarboxylate CAS Name: 4-[[[[2-(3-fluorophenyl)-1-pyrrolidinyl]-oxomethyl]amino]methyl]-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[[2-(3-fluorophenyl)pyrrolidine-1-carbonyl]amino]methyl]cyclohexane-1-carboxylate Traditional Name: 4-[[[2-(3-fluorophenyl)pyrrolidine-1-carbonyl]amino]methyl]cyclohexanecarboxylic acid ethyl ester Formula: C21H29FN2O3 MolecularWeight: 376.464963

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(CC1)CNC(=O)N2CCCC2C3=CC(=CC=C3)F

Isomeric SMILES

CCOC(=O)C1CCC(CC1)CNC(=O)N2CCCC2C3=CC(=CC=C3)F

InChI

InChI=1S/C21H29FN2O3/c1-2-27-20(25)16-10-8-15(9-11-16)14-23-21(26)24-12-4-7-19(24)17-5-3-6-18(22)13-17/h3,5-6,13,15-16,19H,2,4,7-12,14H2,1H3,(H,23,26)