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

Systemtic Name: N-[4-bromanyl-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)propanamide CAS Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]-3-pyrazolyl]-2-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-[4-bromo-1-(2-chlorobenzyl)pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)propionamide Formula: C16H14BrClN6O3 MolecularWeight: 453.67776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NN(C=C1Br)CC2=CC=CC=C2Cl)N3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=NN(C=C1Br)CC2=CC=CC=C2Cl)N3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H14BrClN6O3/c1-10(23-8-12(6-19-23)24(26)27)16(25)20-15-13(17)9-22(21-15)7-11-4-2-3-5-14(11)18/h2-6,8-10H,7H2,1H3,(H,20,21,25)