[4-[(2S)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl]oxyphenyl]methylazanium

Systemtic Name: [4-[(2S)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl]oxyphenyl]methylazanium Openeye Name: [4-[(1S)-2-(tert-butylamino)-1-methyl-2-oxo-ethoxy]phenyl]methylammonium CAS Name: [4-[(2S)-1-(tert-butylamino)-1-oxopropan-2-yl]oxyphenyl]methylammonium IUPAC Name: [4-[(2S)-1-(tert-butylamino)-1-oxopropan-2-yl]oxyphenyl]methylazanium Traditional Name: [4-[(1S)-2-(tert-butylamino)-2-keto-1-methyl-ethoxy]benzyl]ammonium Formula: C14H23N2O2+ MolecularWeight: 251.34462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O2/c1-10(13(17)16-14(2,3)4)18-12-7-5-11(9-15)6-8-12/h5-8,10H,9,15H2,1-4H3,(H,16,17)/p+1/t10-/m0/s1