N-[1-[(3-chloranylphenoxy)methyl]pyrazol-4-yl]-3-(5-methyl-3-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-[1-[(3-chloranylphenoxy)methyl]pyrazol-4-yl]-3-(5-methyl-3-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[1-[(3-chlorophenoxy)methyl]pyrazol-4-yl]-3-(5-methyl-3-nitro-pyrazol-1-yl)propanamide CAS Name: N-[1-[(3-chlorophenoxy)methyl]-4-pyrazolyl]-3-(5-methyl-3-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-[(3-chlorophenoxy)methyl]pyrazol-4-yl]-3-(5-methyl-3-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-[(3-chlorophenoxy)methyl]pyrazol-4-yl]-3-(5-methyl-3-nitro-pyrazol-1-yl)propionamide Formula: C17H17ClN6O4 MolecularWeight: 404.80768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCC(=O)NC2=CN(N=C2)COC3=CC(=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CCC(=O)NC2=CN(N=C2)COC3=CC(=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H17ClN6O4/c1-12-7-16(24(26)27)21-23(12)6-5-17(25)20-14-9-19-22(10-14)11-28-15-4-2-3-13(18)8-15/h2-4,7-10H,5-6,11H2,1H3,(H,20,25)