(1-tert-butyl-5-propan-2-yl-pyrazol-4-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (1-tert-butyl-5-propan-2-yl-pyrazol-4-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: (1-tert-butyl-5-isopropyl-pyrazol-4-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone CAS Name: (1-tert-butyl-5-propan-2-yl-4-pyrazolyl)-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: (1-tert-butyl-5-propan-2-ylpyrazol-4-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: (1-tert-butyl-5-isopropyl-pyrazol-4-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone Formula: C17H31N4O+ MolecularWeight: 307.45424

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=C(N(N=C2)C(C)(C)C)C(C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=C(N(N=C2)C(C)(C)C)C(C)C

InChI

InChI=1S/C17H30N4O/c1-7-19-8-10-20(11-9-19)16(22)14-12-18-21(17(4,5)6)15(14)13(2)3/h12-13H,7-11H2,1-6H3/p+1