(2S,3S)-2-tert-butyl-3-methyl-1-(phenylmethyl)pyrrolidin-1-ium

Systemtic Name: (2S,3S)-2-tert-butyl-3-methyl-1-(phenylmethyl)pyrrolidin-1-ium Openeye Name: (2S,3S)-1-benzyl-2-tert-butyl-3-methyl-pyrrolidin-1-ium CAS Name: (2S,3S)-2-tert-butyl-3-methyl-1-(phenylmethyl)pyrrolidin-1-ium IUPAC Name: (2S,3S)-1-benzyl-2-tert-butyl-3-methylpyrrolidin-1-ium Traditional Name: (2S,3S)-1-benzyl-2-tert-butyl-3-methyl-pyrrolidin-1-ium Formula: C16H26N+ MolecularWeight: 232.38434

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](C1C(C)(C)C)CC2=CC=CC=C2

Isomeric SMILES

C[C@H]1CC[NH+]([C@@H]1C(C)(C)C)CC2=CC=CC=C2

InChI

InChI=1S/C16H25N/c1-13-10-11-17(15(13)16(2,3)4)12-14-8-6-5-7-9-14/h5-9,13,15H,10-12H2,1-4H3/p+1/t13-,15-/m0/s1