1-[1-[2,6-bis(chloranyl)-4-nitro-phenyl]ethyl]-2-oxidanidyl-3-phenyl-pyrazol-2-ium

Systemtic Name: 1-[1-[2,6-bis(chloranyl)-4-nitro-phenyl]ethyl]-2-oxidanidyl-3-phenyl-pyrazol-2-ium Openeye Name: 1-[1-(2,6-dichloro-4-nitro-phenyl)ethyl]-2-oxido-3-phenyl-pyrazol-2-ium CAS Name: 1-[1-(2,6-dichloro-4-nitrophenyl)ethyl]-2-oxido-3-phenylpyrazol-2-ium IUPAC Name: 1-[1-(2,6-dichloro-4-nitrophenyl)ethyl]-2-oxido-3-phenylpyrazol-2-ium Traditional Name: 1-[1-(2,6-dichloro-4-nitro-phenyl)ethyl]-2-oxido-3-phenyl-pyrazol-2-ium Formula: C17H13Cl2N3O3 MolecularWeight: 378.20942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1Cl)[N+](=O)[O-])Cl)N2C=CC(=[N+]2[O-])C3=CC=CC=C3

Isomeric SMILES

CC(C1=C(C=C(C=C1Cl)[N+](=O)[O-])Cl)N2C=CC(=[N+]2[O-])C3=CC=CC=C3

InChI

InChI=1S/C17H13Cl2N3O3/c1-11(17-14(18)9-13(22(24)25)10-15(17)19)20-8-7-16(21(20)23)12-5-3-2-4-6-12/h2-11H,1H3