N-[(2-fluorophenyl)methyl]-4-(4-nitropyrazol-1-yl)butanamide

Systemtic Name: N-[(2-fluorophenyl)methyl]-4-(4-nitropyrazol-1-yl)butanamide Openeye Name: N-[(2-fluorophenyl)methyl]-4-(4-nitropyrazol-1-yl)butanamide CAS Name: N-[(2-fluorophenyl)methyl]-4-(4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[(2-fluorophenyl)methyl]-4-(4-nitropyrazol-1-yl)butanamide Traditional Name: N-(2-fluorobenzyl)-4-(4-nitropyrazol-1-yl)butyramide Formula: C14H15FN4O3 MolecularWeight: 306.292303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)CCCN2C=C(C=N2)[N+](=O)[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)CCCN2C=C(C=N2)[N+](=O)[O-])F

InChI

InChI=1S/C14H15FN4O3/c15-13-5-2-1-4-11(13)8-16-14(20)6-3-7-18-10-12(9-17-18)19(21)22/h1-2,4-5,9-10H,3,6-8H2,(H,16,20)