[(2S)-4-methylpentan-2-yl]-[3-[methyl(phenyl)amino]propyl]azanium

Systemtic Name: [(2S)-4-methylpentan-2-yl]-[3-[methyl(phenyl)amino]propyl]azanium Openeye Name: [(1S)-1,3-dimethylbutyl]-[3-(N-methylanilino)propyl]ammonium CAS Name: 3-(N-methylanilino)propyl-[(2S)-4-methylpentan-2-yl]ammonium IUPAC Name: 3-(N-methylanilino)propyl-[(2S)-4-methylpentan-2-yl]azanium Traditional Name: [(1S)-1,3-dimethylbutyl]-[3-(N-methylanilino)propyl]ammonium Formula: C16H29N2+ MolecularWeight: 249.41486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H28N2/c1-14(2)13-15(3)17-11-8-12-18(4)16-9-6-5-7-10-16/h5-7,9-10,14-15,17H,8,11-13H2,1-4H3/p+1/t15-/m0/s1