[(2S,3S)-2-[ethyl-(2-methylphenyl)amino]pentan-3-yl]azanium

Systemtic Name: [(2S,3S)-2-[ethyl-(2-methylphenyl)amino]pentan-3-yl]azanium Openeye Name: [(1S,2S)-1-ethyl-2-(N-ethyl-2-methyl-anilino)propyl]ammonium CAS Name: [(2S,3S)-2-(N-ethyl-2-methylanilino)pentan-3-yl]ammonium IUPAC Name: [(2S,3S)-2-(N-ethyl-2-methylanilino)pentan-3-yl]azanium Traditional Name: [(1S,2S)-1-ethyl-2-(N-ethyl-2-methyl-anilino)propyl]ammonium Formula: C14H25N2+ MolecularWeight: 221.3617

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)N(CC)C1=CC=CC=C1C)[NH3+]

Isomeric SMILES

CC[C@@H]([C@H](C)N(CC)C1=CC=CC=C1C)[NH3+]

InChI

InChI=1S/C14H24N2/c1-5-13(15)12(4)16(6-2)14-10-8-7-9-11(14)3/h7-10,12-13H,5-6,15H2,1-4H3/p+1/t12-,13-/m0/s1