[(2S)-butan-2-yl]-[3-[methyl(phenyl)amino]propyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[3-[methyl(phenyl)amino]propyl]azanium Openeye Name: 3-(N-methylanilino)propyl-[(1S)-1-methylpropyl]ammonium CAS Name: [(2S)-butan-2-yl]-[3-(N-methylanilino)propyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[3-(N-methylanilino)propyl]azanium Traditional Name: 3-(N-methylanilino)propyl-[(1S)-1-methylpropyl]ammonium Formula: C14H25N2+ MolecularWeight: 221.3617

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CCCN(C)C1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C14H24N2/c1-4-13(2)15-11-8-12-16(3)14-9-6-5-7-10-14/h5-7,9-10,13,15H,4,8,11-12H2,1-3H3/p+1/t13-/m0/s1