[(2S)-2-[(4-bromophenyl)methyl]-3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propyl]-methyl-azanium

Systemtic Name: [(2S)-2-[(4-bromophenyl)methyl]-3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propyl]-methyl-azanium Openeye Name: [(2S)-2-[(4-bromophenyl)methyl]-3-tert-butoxy-3-oxo-propyl]-methyl-ammonium CAS Name: [(2S)-2-[(4-bromophenyl)methyl]-3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-methylammonium IUPAC Name: [(2S)-2-[(4-bromophenyl)methyl]-3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-methylazanium Traditional Name: [(2S)-2-(4-bromobenzyl)-3-tert-butoxy-3-keto-propyl]-methyl-ammonium Formula: C15H23BrNO2+ MolecularWeight: 329.25262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CC=C(C=C1)Br)C[NH2+]C

Isomeric SMILES

CC(C)(C)OC(=O)[C@@H](CC1=CC=C(C=C1)Br)C[NH2+]C

InChI

InChI=1S/C15H22BrNO2/c1-15(2,3)19-14(18)12(10-17-4)9-11-5-7-13(16)8-6-11/h5-8,12,17H,9-10H2,1-4H3/p+1/t12-/m0/s1