[4-[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl]oxy-3,5-dimethyl-phenyl]methylazanium

Systemtic Name: [4-[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl]oxy-3,5-dimethyl-phenyl]methylazanium Openeye Name: [4-[(1S)-2-(ethylamino)-1-methyl-2-oxo-ethoxy]-3,5-dimethyl-phenyl]methylammonium CAS Name: [4-[(2S)-1-(ethylamino)-1-oxopropan-2-yl]oxy-3,5-dimethylphenyl]methylammonium IUPAC Name: [4-[(2S)-1-(ethylamino)-1-oxopropan-2-yl]oxy-3,5-dimethylphenyl]methylazanium Traditional Name: [4-[(1S)-2-(ethylamino)-2-keto-1-methyl-ethoxy]-3,5-dimethyl-benzyl]ammonium Formula: C14H23N2O2+ MolecularWeight: 251.34462

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC1=C(C=C(C=C1C)C[NH3+])C

Isomeric SMILES

CCNC(=O)[C@H](C)OC1=C(C=C(C=C1C)C[NH3+])C

InChI

InChI=1S/C14H22N2O2/c1-5-16-14(17)11(4)18-13-9(2)6-12(8-15)7-10(13)3/h6-7,11H,5,8,15H2,1-4H3,(H,16,17)/p+1/t11-/m0/s1