[(3S)-2,2-dimethyl-3-[(3-methyl-1-benzofuran-2-yl)carbonyloxy]butyl]-dimethyl-azanium

Systemtic Name: [(3S)-2,2-dimethyl-3-[(3-methyl-1-benzofuran-2-yl)carbonyloxy]butyl]-dimethyl-azanium Openeye Name: [(3S)-2,2-dimethyl-3-(3-methylbenzofuran-2-carbonyl)oxy-butyl]-dimethyl-ammonium CAS Name: [(3S)-2,2-dimethyl-3-[(3-methyl-2-benzofuranyl)-oxomethoxy]butyl]-dimethylammonium IUPAC Name: [(3S)-2,2-dimethyl-3-(3-methyl-1-benzofuran-2-carbonyl)oxybutyl]-dimethylazanium Traditional Name: [(3S)-2,2-dimethyl-3-(3-methylbenzofuran-2-carbonyl)oxy-butyl]-dimethyl-ammonium Formula: C18H26NO3+ MolecularWeight: 304.40394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)OC(C)C(C)(C)C[NH+](C)C

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)O[C@@H](C)C(C)(C)C[NH+](C)C

InChI

InChI=1S/C18H25NO3/c1-12-14-9-7-8-10-15(14)22-16(12)17(20)21-13(2)18(3,4)11-19(5)6/h7-10,13H,11H2,1-6H3/p+1/t13-/m0/s1