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

Systemtic Name: [3-ethoxy-4-[(2R)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl]oxy-phenyl]methylazanium Openeye Name: [3-ethoxy-4-[(1R)-1-methyl-2-(methylcarbamoylamino)-2-oxo-ethoxy]phenyl]methylammonium CAS Name: [3-ethoxy-4-[(2R)-1-(methylcarbamoylamino)-1-oxopropan-2-yl]oxyphenyl]methylammonium IUPAC Name: [3-ethoxy-4-[(2R)-1-(methylcarbamoylamino)-1-oxopropan-2-yl]oxyphenyl]methylazanium Traditional Name: [3-ethoxy-4-[(1R)-2-keto-1-methyl-2-(methylcarbamoylamino)ethoxy]benzyl]ammonium Formula: C14H22N3O4+ MolecularWeight: 296.34218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O4/c1-4-20-12-7-10(8-15)5-6-11(12)21-9(2)13(18)17-14(19)16-3/h5-7,9H,4,8,15H2,1-3H3,(H2,16,17,18,19)/p+1/t9-/m1/s1