[4-[(1S)-1-azanyl-2-oxidanylidene-ethyl]phenyl]methyl-ethyl-(2-hydroxyethyl)azanium

Systemtic Name: [4-[(1S)-1-azanyl-2-oxidanylidene-ethyl]phenyl]methyl-ethyl-(2-hydroxyethyl)azanium Openeye Name: [4-[(1S)-1-amino-2-oxo-ethyl]phenyl]methyl-ethyl-(2-hydroxyethyl)ammonium CAS Name: [4-[(1S)-1-amino-2-oxoethyl]phenyl]methyl-ethyl-(2-hydroxyethyl)ammonium IUPAC Name: [4-[(1S)-1-amino-2-oxoethyl]phenyl]methyl-ethyl-(2-hydroxyethyl)azanium Traditional Name: [4-[(1S)-1-amino-2-keto-ethyl]benzyl]-ethyl-(2-hydroxyethyl)ammonium Formula: C13H21N2O2+ MolecularWeight: 237.31804

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCO)CC1=CC=C(C=C1)C(C=O)N

Isomeric SMILES

CC[NH+](CCO)CC1=CC=C(C=C1)[C@@H](C=O)N

InChI

InChI=1S/C13H20N2O2/c1-2-15(7-8-16)9-11-3-5-12(6-4-11)13(14)10-17/h3-6,10,13,16H,2,7-9,14H2,1H3/p+1/t13-/m1/s1