[(2S)-butan-2-yl]-[(4-dimethylaminophenyl)methyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[(4-dimethylaminophenyl)methyl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-[(1S)-1-methylpropyl]ammonium CAS Name: [(2S)-butan-2-yl]-[(4-dimethylaminophenyl)methyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[(4-dimethylaminophenyl)methyl]azanium Traditional Name: [4-(dimethylamino)benzyl]-[(1S)-1-methylpropyl]ammonium Formula: C13H23N2+ MolecularWeight: 207.33512

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CC1=CC=C(C=C1)N(C)C

Isomeric SMILES

CC[C@H](C)[NH2+]CC1=CC=C(C=C1)N(C)C

InChI

InChI=1S/C13H22N2/c1-5-11(2)14-10-12-6-8-13(9-7-12)15(3)4/h6-9,11,14H,5,10H2,1-4H3/p+1/t11-/m0/s1