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

Systemtic Name: N-[3-[(4-chloranylpyrazol-1-yl)methyl]phenyl]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-[3-[(4-chloro-1-pyrazolyl)methyl]phenyl]-3-(3,5-dimethyl-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]-3-(3,5-dimethyl-4-nitropyrazol-1-yl)propanamide Traditional Name: N-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]-3-(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(=NN1CCC(=O)NC2=CC=CC(=C2)CN3C=C(C=N3)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)NC2=CC=CC(=C2)CN3C=C(C=N3)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C18H19ClN6O3/c1-12-18(25(27)28)13(2)24(22-12)7-6-17(26)21-16-5-3-4-14(8-16)10-23-11-15(19)9-20-23/h3-5,8-9,11H,6-7,10H2,1-2H3,(H,21,26)