[(2S)-2-(4-tert-butylphenoxy)propyl]-(3-methoxypropyl)azanium

Systemtic Name: [(2S)-2-(4-tert-butylphenoxy)propyl]-(3-methoxypropyl)azanium Openeye Name: [(2S)-2-(4-tert-butylphenoxy)propyl]-(3-methoxypropyl)ammonium CAS Name: [(2S)-2-(4-tert-butylphenoxy)propyl]-(3-methoxypropyl)ammonium IUPAC Name: [(2S)-2-(4-tert-butylphenoxy)propyl]-(3-methoxypropyl)azanium Traditional Name: [(2S)-2-(4-tert-butylphenoxy)propyl]-(3-methoxypropyl)ammonium Formula: C17H30NO2+ MolecularWeight: 280.4256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH2+]CCCOC)OC1=CC=C(C=C1)C(C)(C)C

Isomeric SMILES

C[C@@H](C[NH2+]CCCOC)OC1=CC=C(C=C1)C(C)(C)C

InChI

InChI=1S/C17H29NO2/c1-14(13-18-11-6-12-19-5)20-16-9-7-15(8-10-16)17(2,3)4/h7-10,14,18H,6,11-13H2,1-5H3/p+1/t14-/m0/s1