[1-[3,5-bis(trifluoromethyl)phenyl]-5-oxidanylidene-pyrrolidin-3-yl] hydrogen carbonate

Systemtic Name: [1-[3,5-bis(trifluoromethyl)phenyl]-5-oxidanylidene-pyrrolidin-3-yl] hydrogen carbonate Openeye Name: [1-[3,5-bis(trifluoromethyl)phenyl]-5-oxo-pyrrolidin-3-yl] hydrogen carbonate CAS Name: carbonic acid [1-[3,5-bis(trifluoromethyl)phenyl]-5-oxo-3-pyrrolidinyl] ester IUPAC Name: [1-[3,5-bis(trifluoromethyl)phenyl]-5-oxopyrrolidin-3-yl] hydrogen carbonate Traditional Name: carbonic acid [1-[3,5-bis(trifluoromethyl)phenyl]-5-keto-pyrrolidin-3-yl] ester Formula: C13H9F6NO4 MolecularWeight: 357.205279

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)OC(=O)O

Isomeric SMILES

C1C(CN(C1=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)OC(=O)O

InChI

InChI=1S/C13H9F6NO4/c14-12(15,16)6-1-7(13(17,18)19)3-8(2-6)20-5-9(4-10(20)21)24-11(22)23/h1-3,9H,4-5H2,(H,22,23)