3,5-dimethyl-1-[2-nitro-1-(3,4,5-trimethoxyphenyl)ethyl]pyrazole

Systemtic Name: 3,5-dimethyl-1-[2-nitro-1-(3,4,5-trimethoxyphenyl)ethyl]pyrazole Openeye Name: 3,5-dimethyl-1-[2-nitro-1-(3,4,5-trimethoxyphenyl)ethyl]pyrazole CAS Name: 3,5-dimethyl-1-[2-nitro-1-(3,4,5-trimethoxyphenyl)ethyl]pyrazole IUPAC Name: 3,5-dimethyl-1-[2-nitro-1-(3,4,5-trimethoxyphenyl)ethyl]pyrazole Traditional Name: 3,5-dimethyl-1-[2-nitro-1-(3,4,5-trimethoxyphenyl)ethyl]pyrazole Formula: C16H21N3O5 MolecularWeight: 335.35504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(C[N+](=O)[O-])C2=CC(=C(C(=C2)OC)OC)OC)C

Isomeric SMILES

CC1=CC(=NN1C(C[N+](=O)[O-])C2=CC(=C(C(=C2)OC)OC)OC)C

InChI

InChI=1S/C16H21N3O5/c1-10-6-11(2)19(17-10)13(9-18(20)21)12-7-14(22-3)16(24-5)15(8-12)23-4/h6-8,13H,9H2,1-5H3