4-(2-chloranyl-4-nitro-phenyl)-1-(phenylmethyl)pyrazole

Systemtic Name: 4-(2-chloranyl-4-nitro-phenyl)-1-(phenylmethyl)pyrazole Openeye Name: 1-benzyl-4-(2-chloro-4-nitro-phenyl)pyrazole CAS Name: 4-(2-chloro-4-nitrophenyl)-1-(phenylmethyl)pyrazole IUPAC Name: 1-benzyl-4-(2-chloro-4-nitrophenyl)pyrazole Traditional Name: 1-benzyl-4-(2-chloro-4-nitro-phenyl)pyrazole Formula: C16H12ClN3O2 MolecularWeight: 313.73838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=N2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=N2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H12ClN3O2/c17-16-8-14(20(21)22)6-7-15(16)13-9-18-19(11-13)10-12-4-2-1-3-5-12/h1-9,11H,10H2