[(2S)-5-methylhexan-2-yl]-[3-[methyl(phenyl)amino]propyl]azanium

Systemtic Name: [(2S)-5-methylhexan-2-yl]-[3-[methyl(phenyl)amino]propyl]azanium Openeye Name: [(1S)-1,4-dimethylpentyl]-[3-(N-methylanilino)propyl]ammonium CAS Name: 3-(N-methylanilino)propyl-[(2S)-5-methylhexan-2-yl]ammonium IUPAC Name: 3-(N-methylanilino)propyl-[(2S)-5-methylhexan-2-yl]azanium Traditional Name: [(1S)-1,4-dimethylpentyl]-[3-(N-methylanilino)propyl]ammonium Formula: C17H31N2+ MolecularWeight: 263.44144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H30N2/c1-15(2)11-12-16(3)18-13-8-14-19(4)17-9-6-5-7-10-17/h5-7,9-10,15-16,18H,8,11-14H2,1-4H3/p+1/t16-/m0/s1