N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-4-pyrazolyl]-2-(3,5-dimethyl-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-(4-chlorobenzyl)pyrazol-4-yl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propionamide Formula: C18H19ClN6O3 MolecularWeight: 402.83486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)C(=O)NC2=CN(N=C2)CC3=CC=C(C=C3)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C(C)C(=O)NC2=CN(N=C2)CC3=CC=C(C=C3)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C18H19ClN6O3/c1-11-17(25(27)28)12(2)24(22-11)13(3)18(26)21-16-8-20-23(10-16)9-14-4-6-15(19)7-5-14/h4-8,10,13H,9H2,1-3H3,(H,21,26)