2-[4-[(2S)-1-(2-methylbutan-2-ylamino)-1-oxidanylidene-propan-2-yl]oxyphenyl]ethylazanium

Systemtic Name: 2-[4-[(2S)-1-(2-methylbutan-2-ylamino)-1-oxidanylidene-propan-2-yl]oxyphenyl]ethylazanium Openeye Name: 2-[4-[(1S)-2-(1,1-dimethylpropylamino)-1-methyl-2-oxo-ethoxy]phenyl]ethylammonium CAS Name: 2-[4-[(2S)-1-(2-methylbutan-2-ylamino)-1-oxopropan-2-yl]oxyphenyl]ethylammonium IUPAC Name: 2-[4-[(2S)-1-(2-methylbutan-2-ylamino)-1-oxopropan-2-yl]oxyphenyl]ethylazanium Traditional Name: 2-[4-[(1S)-2-(tert-amylamino)-2-keto-1-methyl-ethoxy]phenyl]ethylammonium Formula: C16H27N2O2+ MolecularWeight: 279.39778

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)C(C)OC1=CC=C(C=C1)CC[NH3+]

Isomeric SMILES

CCC(C)(C)NC(=O)[C@H](C)OC1=CC=C(C=C1)CC[NH3+]

InChI

InChI=1S/C16H26N2O2/c1-5-16(3,4)18-15(19)12(2)20-14-8-6-13(7-9-14)10-11-17/h6-9,12H,5,10-11,17H2,1-4H3,(H,18,19)/p+1/t12-/m0/s1