3-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-(4-nitrophenyl)propanamide

Systemtic Name: 3-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-(4-nitrophenyl)propanamide Openeye Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-(4-nitrophenyl)propanamide CAS Name: 3-(4-bromo-3-nitro-1-pyrazolyl)-N-(4-nitrophenyl)propanamide IUPAC Name: 3-(4-bromo-3-nitropyrazol-1-yl)-N-(4-nitrophenyl)propanamide Traditional Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-(4-nitrophenyl)propionamide Formula: C12H10BrN5O5 MolecularWeight: 384.1423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CCN2C=C(C(=N2)[N+](=O)[O-])Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CCN2C=C(C(=N2)[N+](=O)[O-])Br)[N+](=O)[O-]

InChI

InChI=1S/C12H10BrN5O5/c13-10-7-16(15-12(10)18(22)23)6-5-11(19)14-8-1-3-9(4-2-8)17(20)21/h1-4,7H,5-6H2,(H,14,19)