N-[2,6-bis(bromanyl)-4-nitro-phenyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-[2,6-bis(bromanyl)-4-nitro-phenyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-(2,6-dibromo-4-nitro-phenyl)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-(2,6-dibromo-4-nitrophenyl)-2-(3,5-dimethyl-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(2,6-dibromo-4-nitrophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanamide Traditional Name: N-(2,6-dibromo-4-nitro-phenyl)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propionamide Formula: C14H13Br2N5O5 MolecularWeight: 491.09152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)C(=O)NC2=C(C=C(C=C2Br)[N+](=O)[O-])Br)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C(C)C(=O)NC2=C(C=C(C=C2Br)[N+](=O)[O-])Br)C)[N+](=O)[O-]

InChI

InChI=1S/C14H13Br2N5O5/c1-6-13(21(25)26)7(2)19(18-6)8(3)14(22)17-12-10(15)4-9(20(23)24)5-11(12)16/h4-5,8H,1-3H3,(H,17,22)