N-[4-bromanyl-1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-[4-bromanyl-1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-[4-bromo-1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)propanamide CAS Name: N-[4-bromo-1-[(2,4-dichlorophenyl)methyl]-3-pyrazolyl]-2-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[4-bromo-1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-[4-bromo-1-(2,4-dichlorobenzyl)pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)propionamide Formula: C16H13BrCl2N6O3 MolecularWeight: 488.12282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NN(C=C1Br)CC2=C(C=C(C=C2)Cl)Cl)N3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=NN(C=C1Br)CC2=C(C=C(C=C2)Cl)Cl)N3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H13BrCl2N6O3/c1-9(24-7-12(5-20-24)25(27)28)16(26)21-15-13(17)8-23(22-15)6-10-2-3-11(18)4-14(10)19/h2-5,7-9H,6H2,1H3,(H,21,22,26)