2-[(2S)-3-methylbutan-2-yl]-3H-isoindol-2-ium-1-amine

Systemtic Name: 2-[(2S)-3-methylbutan-2-yl]-3H-isoindol-2-ium-1-amine Openeye Name: 2-[(1S)-1,2-dimethylpropyl]-3H-isoindol-2-ium-1-amine CAS Name: 2-[(2S)-3-methylbutan-2-yl]-3H-isoindol-2-ium-1-amine IUPAC Name: 2-[(2S)-3-methylbutan-2-yl]-3H-isoindol-2-ium-1-amine Traditional Name: [2-[(1S)-1,2-dimethylpropyl]-3H-isoindol-2-ium-1-yl]amine Formula: C13H19N2+ MolecularWeight: 203.30336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)[N+]1=C(C2=CC=CC=C2C1)N

Isomeric SMILES

C[C@@H](C(C)C)[N+]1=C(C2=CC=CC=C2C1)N

InChI

InChI=1S/C13H18N2/c1-9(2)10(3)15-8-11-6-4-5-7-12(11)13(15)14/h4-7,9-10,14H,8H2,1-3H3/p+1/t10-/m0/s1