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

Systemtic Name: N-[1-[(3-chlorophenyl)methyl]pyrazol-4-yl]-3-(3-methyl-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[1-[(3-chlorophenyl)methyl]pyrazol-4-yl]-3-(3-methyl-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-[1-[(3-chlorophenyl)methyl]-4-pyrazolyl]-3-(3-methyl-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-[(3-chlorophenyl)methyl]pyrazol-4-yl]-3-(3-methyl-4-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-(3-chlorobenzyl)pyrazol-4-yl]-3-(3-methyl-4-nitro-pyrazol-1-yl)propionamide Formula: C17H17ClN6O3 MolecularWeight: 388.80828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1[N+](=O)[O-])CCC(=O)NC2=CN(N=C2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=NN(C=C1[N+](=O)[O-])CCC(=O)NC2=CN(N=C2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H17ClN6O3/c1-12-16(24(26)27)11-22(21-12)6-5-17(25)20-15-8-19-23(10-15)9-13-3-2-4-14(18)7-13/h2-4,7-8,10-11H,5-6,9H2,1H3,(H,20,25)