2-acetamidoethyl-[(1S)-1-(4-methyl-2-oxidanyl-phenyl)ethyl]azanium

Systemtic Name: 2-acetamidoethyl-[(1S)-1-(4-methyl-2-oxidanyl-phenyl)ethyl]azanium Openeye Name: 2-acetamidoethyl-[(1S)-1-(2-hydroxy-4-methyl-phenyl)ethyl]ammonium CAS Name: 2-acetamidoethyl-[(1S)-1-(2-hydroxy-4-methylphenyl)ethyl]ammonium IUPAC Name: 2-acetamidoethyl-[(1S)-1-(2-hydroxy-4-methylphenyl)ethyl]azanium Traditional Name: 2-acetamidoethyl-[(1S)-1-(2-hydroxy-4-methyl-phenyl)ethyl]ammonium Formula: C13H21N2O2+ MolecularWeight: 237.31804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)[NH2+]CCNC(=O)C)O

Isomeric SMILES

CC1=CC(=C(C=C1)[C@H](C)[NH2+]CCNC(=O)C)O

InChI

InChI=1S/C13H20N2O2/c1-9-4-5-12(13(17)8-9)10(2)14-6-7-15-11(3)16/h4-5,8,10,14,17H,6-7H2,1-3H3,(H,15,16)/p+1/t10-/m0/s1