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

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-3-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-3-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-4-pyrazolyl]-3-(3-methoxy-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-3-(3-methoxy-4-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-(4-chlorobenzyl)pyrazol-4-yl]-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=CN(N=C2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=NN(C=C1[N+](=O)[O-])CCC(=O)NC2=CN(N=C2)CC3=CC=C(C=C3)Cl

InChI

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