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

Systemtic Name: N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-[1-[(3-chlorophenyl)methyl]-3-pyrazolyl]-2-(3,5-dimethyl-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-(3-chlorobenzyl)pyrazol-3-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=NN(C=C2)CC3=CC(=CC=C3)Cl)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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