[2-acetyloxy-3-methyl-3-[4-(2-methylpropyl)phenyl]-4-oxidanyl-4-oxidanylidene-butyl]-trimethyl-azanium

Systemtic Name: [2-acetyloxy-3-methyl-3-[4-(2-methylpropyl)phenyl]-4-oxidanyl-4-oxidanylidene-butyl]-trimethyl-azanium Openeye Name: [2-acetoxy-4-hydroxy-3-(4-isobutylphenyl)-3-methyl-4-oxo-butyl]-trimethyl-ammonium CAS Name: [2-acetyloxy-4-hydroxy-3-methyl-3-[4-(2-methylpropyl)phenyl]-4-oxobutyl]-trimethylammonium IUPAC Name: [2-acetyloxy-4-hydroxy-3-methyl-3-[4-(2-methylpropyl)phenyl]-4-oxobutyl]-trimethylazanium Traditional Name: [2-acetoxy-4-hydroxy-3-(4-isobutylphenyl)-4-keto-3-methyl-butyl]-trimethyl-ammonium Formula: C20H32NO4+ MolecularWeight: 350.47238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C)(C(C[N+](C)(C)C)OC(=O)C)C(=O)O

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(C)(C(C[N+](C)(C)C)OC(=O)C)C(=O)O

InChI

InChI=1S/C20H31NO4/c1-14(2)12-16-8-10-17(11-9-16)20(4,19(23)24)18(25-15(3)22)13-21(5,6)7/h8-11,14,18H,12-13H2,1-7H3/p+1