[4-[(2R)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl]oxy-3-ethoxy-phenyl]methylazanium

Systemtic Name: [4-[(2R)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl]oxy-3-ethoxy-phenyl]methylazanium Openeye Name: [4-[(1R)-2-(tert-butylamino)-1-methyl-2-oxo-ethoxy]-3-ethoxy-phenyl]methylammonium CAS Name: [4-[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl]oxy-3-ethoxyphenyl]methylammonium IUPAC Name: [4-[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl]oxy-3-ethoxyphenyl]methylazanium Traditional Name: [4-[(1R)-2-(tert-butylamino)-2-keto-1-methyl-ethoxy]-3-ethoxy-benzyl]ammonium Formula: C16H27N2O3+ MolecularWeight: 295.39718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH3+])OC(C)C(=O)NC(C)(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH3+])O[C@H](C)C(=O)NC(C)(C)C

InChI

InChI=1S/C16H26N2O3/c1-6-20-14-9-12(10-17)7-8-13(14)21-11(2)15(19)18-16(3,4)5/h7-9,11H,6,10,17H2,1-5H3,(H,18,19)/p+1/t11-/m1/s1