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

Systemtic Name: N-[3-[(4-chloranylpyrazol-1-yl)methyl]phenyl]-3-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]-3-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-[3-[(4-chloro-1-pyrazolyl)methyl]phenyl]-3-(3-methoxy-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]-3-(3-methoxy-4-nitropyrazol-1-yl)propanamide Traditional Name: N-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]-3-(3-methoxy-4-nitro-pyrazol-1-yl)propionamide Formula: C17H17ClN6O4 MolecularWeight: 404.80768

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN(C=C1[N+](=O)[O-])CCC(=O)NC2=CC=CC(=C2)CN3C=C(C=N3)Cl

Isomeric SMILES

COC1=NN(C=C1[N+](=O)[O-])CCC(=O)NC2=CC=CC(=C2)CN3C=C(C=N3)Cl

InChI

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