2-acetamidoethyl-[(1S)-1-(5-methoxy-2-oxidanyl-phenyl)ethyl]azanium

Systemtic Name: 2-acetamidoethyl-[(1S)-1-(5-methoxy-2-oxidanyl-phenyl)ethyl]azanium Openeye Name: 2-acetamidoethyl-[(1S)-1-(2-hydroxy-5-methoxy-phenyl)ethyl]ammonium CAS Name: 2-acetamidoethyl-[(1S)-1-(2-hydroxy-5-methoxyphenyl)ethyl]ammonium IUPAC Name: 2-acetamidoethyl-[(1S)-1-(2-hydroxy-5-methoxyphenyl)ethyl]azanium Traditional Name: 2-acetamidoethyl-[(1S)-1-(2-hydroxy-5-methoxy-phenyl)ethyl]ammonium Formula: C13H21N2O3+ MolecularWeight: 253.31744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O3/c1-9(14-6-7-15-10(2)16)12-8-11(18-3)4-5-13(12)17/h4-5,8-9,14,17H,6-7H2,1-3H3,(H,15,16)/p+1/t9-/m0/s1