[4-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]methyl-(2-methyl-1-oxidanyl-propan-2-yl)azanium

Systemtic Name: [4-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]methyl-(2-methyl-1-oxidanyl-propan-2-yl)azanium Openeye Name: [4-(2-amino-2-oxo-ethoxy)phenyl]methyl-(2-hydroxy-1,1-dimethyl-ethyl)ammonium CAS Name: [4-(2-amino-2-oxoethoxy)phenyl]methyl-(1-hydroxy-2-methylpropan-2-yl)ammonium IUPAC Name: [4-(2-amino-2-oxoethoxy)phenyl]methyl-(1-hydroxy-2-methylpropan-2-yl)azanium Traditional Name: [4-(2-amino-2-keto-ethoxy)benzyl]-(2-hydroxy-1,1-dimethyl-ethyl)ammonium Formula: C13H21N2O3+ MolecularWeight: 253.31744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)[NH2+]CC1=CC=C(C=C1)OCC(=O)N

Isomeric SMILES

CC(C)(CO)[NH2+]CC1=CC=C(C=C1)OCC(=O)N

InChI

InChI=1S/C13H20N2O3/c1-13(2,9-16)15-7-10-3-5-11(6-4-10)18-8-12(14)17/h3-6,15-16H,7-9H2,1-2H3,(H2,14,17)/p+1