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

Systemtic Name: 1-[2-(4-tert-butylphenoxy)ethyl]-3,5-dimethyl-4-nitro-pyrazole Openeye Name: 1-[2-(4-tert-butylphenoxy)ethyl]-3,5-dimethyl-4-nitro-pyrazole CAS Name: 1-[2-(4-tert-butylphenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole IUPAC Name: 1-[2-(4-tert-butylphenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole Traditional Name: 1-[2-(4-tert-butylphenoxy)ethyl]-3,5-dimethyl-4-nitro-pyrazole Formula: C17H23N3O3 MolecularWeight: 317.38282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCOC2=CC=C(C=C2)C(C)(C)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCOC2=CC=C(C=C2)C(C)(C)C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H23N3O3/c1-12-16(20(21)22)13(2)19(18-12)10-11-23-15-8-6-14(7-9-15)17(3,4)5/h6-9H,10-11H2,1-5H3