[4-[(2S)-1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl]oxyphenyl]methylazanium

Systemtic Name: [4-[(2S)-1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl]oxyphenyl]methylazanium Openeye Name: [4-[(1S)-2-(2-methoxyethylamino)-1-methyl-2-oxo-ethoxy]phenyl]methylammonium CAS Name: [4-[(2S)-1-(2-methoxyethylamino)-1-oxopropan-2-yl]oxyphenyl]methylammonium IUPAC Name: [4-[(2S)-1-(2-methoxyethylamino)-1-oxopropan-2-yl]oxyphenyl]methylazanium Traditional Name: [4-[(1S)-2-keto-2-(2-methoxyethylamino)-1-methyl-ethoxy]benzyl]ammonium Formula: C13H21N2O3+ MolecularWeight: 253.31744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCOC)OC1=CC=C(C=C1)C[NH3+]

Isomeric SMILES

C[C@@H](C(=O)NCCOC)OC1=CC=C(C=C1)C[NH3+]

InChI

InChI=1S/C13H20N2O3/c1-10(13(16)15-7-8-17-2)18-12-5-3-11(9-14)4-6-12/h3-6,10H,7-9,14H2,1-2H3,(H,15,16)/p+1/t10-/m0/s1