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

Systemtic Name: [2-acetyloxy-3-[4-(2-methylpropyl)phenyl]-4-oxidanyl-4-oxidanylidene-butyl]-trimethyl-azanium Openeye Name: [2-acetoxy-4-hydroxy-3-(4-isobutylphenyl)-4-oxo-butyl]-trimethyl-ammonium CAS Name: [2-acetyloxy-4-hydroxy-3-[4-(2-methylpropyl)phenyl]-4-oxobutyl]-trimethylammonium IUPAC Name: [2-acetyloxy-4-hydroxy-3-[4-(2-methylpropyl)phenyl]-4-oxobutyl]-trimethylazanium Traditional Name: [2-acetoxy-4-hydroxy-3-(4-isobutylphenyl)-4-keto-butyl]-trimethyl-ammonium Formula: C19H30NO4+ MolecularWeight: 336.4458

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C19H29NO4/c1-13(2)11-15-7-9-16(10-8-15)18(19(22)23)17(24-14(3)21)12-20(4,5)6/h7-10,13,17-18H,11-12H2,1-6H3/p+1