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

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

Isomeric SMILES

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

InChI

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