[2-(tert-butylamino)-2-oxidanylidene-ethyl]-ethyl-[(1-phenylpyrazol-4-yl)methyl]azanium

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl]-ethyl-[(1-phenylpyrazol-4-yl)methyl]azanium Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl]-ethyl-[(1-phenylpyrazol-4-yl)methyl]ammonium CAS Name: [2-(tert-butylamino)-2-oxoethyl]-ethyl-[(1-phenyl-4-pyrazolyl)methyl]ammonium IUPAC Name: [2-(tert-butylamino)-2-oxoethyl]-ethyl-[(1-phenylpyrazol-4-yl)methyl]azanium Traditional Name: [2-(tert-butylamino)-2-keto-ethyl]-ethyl-[(1-phenylpyrazol-4-yl)methyl]ammonium Formula: C18H27N4O+ MolecularWeight: 315.43318

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CN(N=C1)C2=CC=CC=C2)CC(=O)NC(C)(C)C

Isomeric SMILES

CC[NH+](CC1=CN(N=C1)C2=CC=CC=C2)CC(=O)NC(C)(C)C

InChI

InChI=1S/C18H26N4O/c1-5-21(14-17(23)20-18(2,3)4)12-15-11-19-22(13-15)16-9-7-6-8-10-16/h6-11,13H,5,12,14H2,1-4H3,(H,20,23)/p+1