1-[4-[(2-fluoranyl-4-nitro-phenyl)amino]pyrrolidin-2-yl]carbonylpyrrolidine-2-carbonitrile

Systemtic Name: 1-[4-[(2-fluoranyl-4-nitro-phenyl)amino]pyrrolidin-2-yl]carbonylpyrrolidine-2-carbonitrile Openeye Name: 1-[4-(2-fluoro-4-nitro-anilino)pyrrolidine-2-carbonyl]pyrrolidine-2-carbonitrile CAS Name: 1-[[4-(2-fluoro-4-nitroanilino)-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarbonitrile IUPAC Name: 1-[4-(2-fluoro-4-nitroanilino)pyrrolidine-2-carbonyl]pyrrolidine-2-carbonitrile Traditional Name: 1-[4-(2-fluoro-4-nitro-anilino)prolyl]pyrrolidine-2-carbonitrile Formula: C16H18FN5O3 MolecularWeight: 347.344223

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CC(CN2)NC3=C(C=C(C=C3)[N+](=O)[O-])F)C#N

Isomeric SMILES

C1CC(N(C1)C(=O)C2CC(CN2)NC3=C(C=C(C=C3)[N+](=O)[O-])F)C#N

InChI

InChI=1S/C16H18FN5O3/c17-13-7-11(22(24)25)3-4-14(13)20-10-6-15(19-9-10)16(23)21-5-1-2-12(21)8-18/h3-4,7,10,12,15,19-20H,1-2,5-6,9H2