N-[2,6-bis(bromanyl)-4-nitro-phenyl]-3-(4-bromanylpyrazol-1-yl)propanamide

Systemtic Name: N-[2,6-bis(bromanyl)-4-nitro-phenyl]-3-(4-bromanylpyrazol-1-yl)propanamide Openeye Name: 3-(4-bromopyrazol-1-yl)-N-(2,6-dibromo-4-nitro-phenyl)propanamide CAS Name: 3-(4-bromo-1-pyrazolyl)-N-(2,6-dibromo-4-nitrophenyl)propanamide IUPAC Name: 3-(4-bromopyrazol-1-yl)-N-(2,6-dibromo-4-nitrophenyl)propanamide Traditional Name: 3-(4-bromopyrazol-1-yl)-N-(2,6-dibromo-4-nitro-phenyl)propionamide Formula: C12H9Br3N4O3 MolecularWeight: 496.93686

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Br)NC(=O)CCN2C=C(C=N2)Br)Br)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1Br)NC(=O)CCN2C=C(C=N2)Br)Br)[N+](=O)[O-]

InChI

InChI=1S/C12H9Br3N4O3/c13-7-5-16-18(6-7)2-1-11(20)17-12-9(14)3-8(19(21)22)4-10(12)15/h3-6H,1-2H2,(H,17,20)