N-[[1-[3,6-bis(fluoranyl)-2-methyl-4-nitro-phenyl]pyrrolidin-3-yl]methyl]ethanamide

Systemtic Name: N-[[1-[3,6-bis(fluoranyl)-2-methyl-4-nitro-phenyl]pyrrolidin-3-yl]methyl]ethanamide Openeye Name: N-[[1-(3,6-difluoro-2-methyl-4-nitro-phenyl)pyrrolidin-3-yl]methyl]acetamide CAS Name: N-[[1-(3,6-difluoro-2-methyl-4-nitrophenyl)-3-pyrrolidinyl]methyl]acetamide IUPAC Name: N-[[1-(3,6-difluoro-2-methyl-4-nitrophenyl)pyrrolidin-3-yl]methyl]acetamide Traditional Name: N-[[1-(3,6-difluoro-2-methyl-4-nitro-phenyl)pyrrolidin-3-yl]methyl]acetamide Formula: C14H17F2N3O3 MolecularWeight: 313.299886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1N2CCC(C2)CNC(=O)C)F)[N+](=O)[O-])F

Isomeric SMILES

CC1=C(C(=CC(=C1N2CCC(C2)CNC(=O)C)F)[N+](=O)[O-])F

InChI

InChI=1S/C14H17F2N3O3/c1-8-13(16)12(19(21)22)5-11(15)14(8)18-4-3-10(7-18)6-17-9(2)20/h5,10H,3-4,6-7H2,1-2H3,(H,17,20)