2-[[(2S)-2-(4-chloranyl-2-methyl-phenoxy)propanoyl]amino]ethylazanium

Systemtic Name: 2-[[(2S)-2-(4-chloranyl-2-methyl-phenoxy)propanoyl]amino]ethylazanium Openeye Name: 2-[[(2S)-2-(4-chloro-2-methyl-phenoxy)propanoyl]amino]ethylammonium CAS Name: 2-[[(2S)-2-(4-chloro-2-methylphenoxy)-1-oxopropyl]amino]ethylammonium IUPAC Name: 2-[[(2S)-2-(4-chloro-2-methylphenoxy)propanoyl]amino]ethylazanium Traditional Name: 2-[[(2S)-2-(4-chloro-2-methyl-phenoxy)propanoyl]amino]ethylammonium Formula: C12H18ClN2O2+ MolecularWeight: 257.73652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OC(C)C(=O)NCC[NH3+]

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)O[C@@H](C)C(=O)NCC[NH3+]

InChI

InChI=1S/C12H17ClN2O2/c1-8-7-10(13)3-4-11(8)17-9(2)12(16)15-6-5-14/h3-4,7,9H,5-6,14H2,1-2H3,(H,15,16)/p+1/t9-/m0/s1