4-chloranyl-1-methyl-3-[(E)-2-nitroethenyl]pyrazole

Systemtic Name: 4-chloranyl-1-methyl-3-[(E)-2-nitroethenyl]pyrazole Openeye Name: 4-chloro-1-methyl-3-[(E)-2-nitrovinyl]pyrazole CAS Name: 4-chloro-1-methyl-3-[(E)-2-nitroethenyl]pyrazole IUPAC Name: 4-chloro-1-methyl-3-[(E)-2-nitroethenyl]pyrazole Traditional Name: 4-chloro-1-methyl-3-[(E)-2-nitrovinyl]pyrazole Formula: C6H6ClN3O2 MolecularWeight: 187.58374

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C=C[N+](=O)[O-])Cl

Isomeric SMILES

CN1C=C(C(=N1)/C=C/[N+](=O)[O-])Cl

InChI

InChI=1S/C6H6ClN3O2/c1-9-4-5(7)6(8-9)2-3-10(11)12/h2-4H,1H3/b3-2+