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

Systemtic Name: [3-ethoxy-4-[(2R)-1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl]oxy-phenyl]methylazanium Openeye Name: [3-ethoxy-4-[(1R)-2-(isopropylamino)-1-methyl-2-oxo-ethoxy]phenyl]methylammonium CAS Name: [3-ethoxy-4-[(2R)-1-oxo-1-(propan-2-ylamino)propan-2-yl]oxyphenyl]methylammonium IUPAC Name: [3-ethoxy-4-[(2R)-1-oxo-1-(propan-2-ylamino)propan-2-yl]oxyphenyl]methylazanium Traditional Name: [3-ethoxy-4-[(1R)-2-(isopropylamino)-2-keto-1-methyl-ethoxy]benzyl]ammonium Formula: C15H25N2O3+ MolecularWeight: 281.3706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24N2O3/c1-5-19-14-8-12(9-16)6-7-13(14)20-11(4)15(18)17-10(2)3/h6-8,10-11H,5,9,16H2,1-4H3,(H,17,18)/p+1/t11-/m1/s1