5-tert-butyl-2-(4-octoxyphenyl)pyrazol-3-amine

Systemtic Name: 5-tert-butyl-2-(4-octoxyphenyl)pyrazol-3-amine Openeye Name: 5-tert-butyl-2-(4-octoxyphenyl)pyrazol-3-amine CAS Name: 5-tert-butyl-2-(4-octoxyphenyl)-3-pyrazolamine IUPAC Name: 5-tert-butyl-2-(4-octoxyphenyl)pyrazol-3-amine Traditional Name: [5-tert-butyl-2-(4-octoxyphenyl)pyrazol-3-yl]amine Formula: C21H33N3O MolecularWeight: 343.50622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)N

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)N

InChI

InChI=1S/C21H33N3O/c1-5-6-7-8-9-10-15-25-18-13-11-17(12-14-18)24-20(22)16-19(23-24)21(2,3)4/h11-14,16H,5-10,15,22H2,1-4H3