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

Systemtic Name: N-[[1-[3-(cyclopropylamino)-6-fluoranyl-2-methyl-4-nitro-phenyl]pyrrolidin-3-yl]methyl]ethanamide Openeye Name: N-[[1-[3-(cyclopropylamino)-6-fluoro-2-methyl-4-nitro-phenyl]pyrrolidin-3-yl]methyl]acetamide CAS Name: N-[[1-[3-(cyclopropylamino)-6-fluoro-2-methyl-4-nitrophenyl]-3-pyrrolidinyl]methyl]acetamide IUPAC Name: N-[[1-[3-(cyclopropylamino)-6-fluoro-2-methyl-4-nitrophenyl]pyrrolidin-3-yl]methyl]acetamide Traditional Name: N-[[1-[3-(cyclopropylamino)-6-fluoro-2-methyl-4-nitro-phenyl]pyrrolidin-3-yl]methyl]acetamide Formula: C17H23FN4O3 MolecularWeight: 350.387923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1N2CCC(C2)CNC(=O)C)F)[N+](=O)[O-])NC3CC3

Isomeric SMILES

CC1=C(C(=CC(=C1N2CCC(C2)CNC(=O)C)F)[N+](=O)[O-])NC3CC3

InChI

InChI=1S/C17H23FN4O3/c1-10-16(20-13-3-4-13)15(22(24)25)7-14(18)17(10)21-6-5-12(9-21)8-19-11(2)23/h7,12-13,20H,3-6,8-9H2,1-2H3,(H,19,23)