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

Systemtic Name: 3-[methyl(phenyl)amino]propyl-[(2S)-pentan-2-yl]azanium Openeye Name: 3-(N-methylanilino)propyl-[(1S)-1-methylbutyl]ammonium CAS Name: 3-(N-methylanilino)propyl-[(2S)-pentan-2-yl]ammonium IUPAC Name: 3-(N-methylanilino)propyl-[(2S)-pentan-2-yl]azanium Traditional Name: 3-(N-methylanilino)propyl-[(1S)-1-methylbutyl]ammonium Formula: C15H27N2+ MolecularWeight: 235.38828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H26N2/c1-4-9-14(2)16-12-8-13-17(3)15-10-6-5-7-11-15/h5-7,10-11,14,16H,4,8-9,12-13H2,1-3H3/p+1/t14-/m0/s1