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

Systemtic Name: [3-ethoxy-4-[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl]oxy-phenyl]methylazanium Openeye Name: [3-ethoxy-4-[(1S)-2-(ethylamino)-1-methyl-2-oxo-ethoxy]phenyl]methylammonium CAS Name: [3-ethoxy-4-[(2S)-1-(ethylamino)-1-oxopropan-2-yl]oxyphenyl]methylammonium IUPAC Name: [3-ethoxy-4-[(2S)-1-(ethylamino)-1-oxopropan-2-yl]oxyphenyl]methylazanium Traditional Name: [3-ethoxy-4-[(1S)-2-(ethylamino)-2-keto-1-methyl-ethoxy]benzyl]ammonium Formula: C14H23N2O3+ MolecularWeight: 267.34402

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC1=C(C=C(C=C1)C[NH3+])OCC

Isomeric SMILES

CCNC(=O)[C@H](C)OC1=C(C=C(C=C1)C[NH3+])OCC

InChI

InChI=1S/C14H22N2O3/c1-4-16-14(17)10(3)19-12-7-6-11(9-15)8-13(12)18-5-2/h6-8,10H,4-5,9,15H2,1-3H3,(H,16,17)/p+1/t10-/m0/s1