(2S)-2-[(1S,2S)-2-methyl-1-phenyl-butyl]pyrrolidin-1-ium

Systemtic Name: (2S)-2-[(1S,2S)-2-methyl-1-phenyl-butyl]pyrrolidin-1-ium Openeye Name: (2S)-2-[(1S,2S)-2-methyl-1-phenyl-butyl]pyrrolidin-1-ium CAS Name: (2S)-2-[(1S,2S)-2-methyl-1-phenylbutyl]pyrrolidin-1-ium IUPAC Name: (2S)-2-[(1S,2S)-2-methyl-1-phenylbutyl]pyrrolidin-1-ium Traditional Name: (2S)-2-[(1S,2S)-2-methyl-1-phenyl-butyl]pyrrolidin-1-ium Formula: C15H24N+ MolecularWeight: 218.35776

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C1CCC[NH2+]1)C2=CC=CC=C2

Isomeric SMILES

CC[C@H](C)[C@H]([C@@H]1CCC[NH2+]1)C2=CC=CC=C2

InChI

InChI=1S/C15H23N/c1-3-12(2)15(14-10-7-11-16-14)13-8-5-4-6-9-13/h4-6,8-9,12,14-16H,3,7,10-11H2,1-2H3/p+1/t12-,14-,15-/m0/s1