N-[(4-chlorophenyl)methyl]-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)butanamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)butanamide Openeye Name: N-[(4-chlorophenyl)methyl]-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)butanamide CAS Name: N-[(4-chlorophenyl)methyl]-4-(3,5-dimethyl-4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[(4-chlorophenyl)methyl]-4-(3,5-dimethyl-4-nitropyrazol-1-yl)butanamide Traditional Name: N-(4-chlorobenzyl)-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)butyramide Formula: C16H19ClN4O3 MolecularWeight: 350.80006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCC(=O)NCC2=CC=C(C=C2)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCCC(=O)NCC2=CC=C(C=C2)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C16H19ClN4O3/c1-11-16(21(23)24)12(2)20(19-11)9-3-4-15(22)18-10-13-5-7-14(17)8-6-13/h5-8H,3-4,9-10H2,1-2H3,(H,18,22)