ethyl 4-[[1-(3-fluorophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbamoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[1-(3-fluorophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbamoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[1-(3-fluorophenyl)-5-oxo-pyrrolidin-3-yl]carbamoyl]piperazine-1-carboxylate CAS Name: 4-[[[1-(3-fluorophenyl)-5-oxo-3-pyrrolidinyl]amino]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]carbamoyl]piperazine-1-carboxylate Traditional Name: 4-[[1-(3-fluorophenyl)-5-keto-pyrrolidin-3-yl]carbamoyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H23FN4O4 MolecularWeight: 378.398023

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)NC2CC(=O)N(C2)C3=CC(=CC=C3)F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)NC2CC(=O)N(C2)C3=CC(=CC=C3)F

InChI

InChI=1S/C18H23FN4O4/c1-2-27-18(26)22-8-6-21(7-9-22)17(25)20-14-11-16(24)23(12-14)15-5-3-4-13(19)10-15/h3-5,10,14H,2,6-9,11-12H2,1H3,(H,20,25)