triethyl-(2-oxidanyl-4,4-diphenyl-2-propan-2-yl-butyl)azanium ethanoate

Systemtic Name: triethyl-(2-oxidanyl-4,4-diphenyl-2-propan-2-yl-butyl)azanium ethanoate Openeye Name: triethyl-(2-hydroxy-2-isopropyl-4,4-diphenyl-butyl)ammonium acetate CAS Name: triethyl-(2-hydroxy-4,4-diphenyl-2-propan-2-ylbutyl)ammonium acetate IUPAC Name: triethyl-(2-hydroxy-4,4-diphenyl-2-propan-2-ylbutyl)azanium acetate Traditional Name: triethyl-(2-hydroxy-2-isopropyl-4,4-diphenyl-butyl)ammonium acetate Formula: C27H41NO3 MolecularWeight: 427.61934

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)CC(CC(C1=CC=CC=C1)C2=CC=CC=C2)(C(C)C)O.CC(=O)[O-]

Isomeric SMILES

CC[N+](CC)(CC)CC(CC(C1=CC=CC=C1)C2=CC=CC=C2)(C(C)C)O.CC(=O)[O-]

InChI

InChI=1S/C25H38NO.C2H4O2/c1-6-26(7-2,8-3)20-25(27,21(4)5)19-24(22-15-11-9-12-16-22)23-17-13-10-14-18-23;1-2(3)4/h9-18,21,24,27H,6-8,19-20H2,1-5H3;1H3,(H,3,4)/q+1;/p-1