3,5-dimethyl-4-nitro-1-[(3-phenoxyphenyl)methyl]pyrazole

Systemtic Name: 3,5-dimethyl-4-nitro-1-[(3-phenoxyphenyl)methyl]pyrazole Openeye Name: 3,5-dimethyl-4-nitro-1-[(3-phenoxyphenyl)methyl]pyrazole CAS Name: 3,5-dimethyl-4-nitro-1-[(3-phenoxyphenyl)methyl]pyrazole IUPAC Name: 3,5-dimethyl-4-nitro-1-[(3-phenoxyphenyl)methyl]pyrazole Traditional Name: 3,5-dimethyl-4-nitro-1-(3-phenoxybenzyl)pyrazole Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC(=CC=C2)OC3=CC=CC=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=CC=C2)OC3=CC=CC=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O3/c1-13-18(21(22)23)14(2)20(19-13)12-15-7-6-10-17(11-15)24-16-8-4-3-5-9-16/h3-11H,12H2,1-2H3