[(2S)-2-(azaniumylmethyl)-2-methyl-3-(3-methylphenyl)propyl]-diethyl-azanium

Systemtic Name: [(2S)-2-(azaniumylmethyl)-2-methyl-3-(3-methylphenyl)propyl]-diethyl-azanium Openeye Name: [(2S)-2-(azaniumylmethyl)-2-methyl-3-(m-tolyl)propyl]-diethyl-ammonium CAS Name: [(2S)-2-(ammoniomethyl)-2-methyl-3-(3-methylphenyl)propyl]-diethylammonium IUPAC Name: [(2S)-2-(azaniumylmethyl)-2-methyl-3-(3-methylphenyl)propyl]-diethylazanium Traditional Name: [(2S)-2-(ammoniomethyl)-2-methyl-3-(m-tolyl)propyl]-diethyl-ammonium Formula: C16H30N2+2 MolecularWeight: 250.4228

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC(C)(CC1=CC=CC(=C1)C)C[NH3+]

Isomeric SMILES

CC[NH+](CC)C[C@@](C)(CC1=CC=CC(=C1)C)C[NH3+]

InChI

InChI=1S/C16H28N2/c1-5-18(6-2)13-16(4,12-17)11-15-9-7-8-14(3)10-15/h7-10H,5-6,11-13,17H2,1-4H3/p+2/t16-/m0/s1