N-[2,5-bis(chloranyl)phenyl]-3-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-[2,5-bis(chloranyl)phenyl]-3-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-(2,5-dichlorophenyl)-3-(4-nitropyrazol-1-yl)propanamide CAS Name: N-(2,5-dichlorophenyl)-3-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(2,5-dichlorophenyl)-3-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-(2,5-dichlorophenyl)-3-(4-nitropyrazol-1-yl)propionamide Formula: C12H10Cl2N4O3 MolecularWeight: 329.1388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)NC(=O)CCN2C=C(C=N2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1Cl)NC(=O)CCN2C=C(C=N2)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H10Cl2N4O3/c13-8-1-2-10(14)11(5-8)16-12(19)3-4-17-7-9(6-15-17)18(20)21/h1-2,5-7H,3-4H2,(H,16,19)