[(2S)-2-azanyl-2-(2,4-dimethylphenyl)ethyl]-dipropyl-azanium

Systemtic Name: [(2S)-2-azanyl-2-(2,4-dimethylphenyl)ethyl]-dipropyl-azanium Openeye Name: [(2S)-2-amino-2-(2,4-dimethylphenyl)ethyl]-dipropyl-ammonium CAS Name: [(2S)-2-amino-2-(2,4-dimethylphenyl)ethyl]-dipropylammonium IUPAC Name: [(2S)-2-amino-2-(2,4-dimethylphenyl)ethyl]-dipropylazanium Traditional Name: [(2S)-2-amino-2-(2,4-dimethylphenyl)ethyl]-dipropyl-ammonium Formula: C16H29N2+ MolecularWeight: 249.41486

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCC)CC(C1=C(C=C(C=C1)C)C)N

Isomeric SMILES

CCC[NH+](CCC)C[C@H](C1=C(C=C(C=C1)C)C)N

InChI

InChI=1S/C16H28N2/c1-5-9-18(10-6-2)12-16(17)15-8-7-13(3)11-14(15)4/h7-8,11,16H,5-6,9-10,12,17H2,1-4H3/p+1/t16-/m1/s1