(4-acetamidophenyl)methyl-[(1S)-1-pyridin-2-ylethyl]azanium

Systemtic Name: (4-acetamidophenyl)methyl-[(1S)-1-pyridin-2-ylethyl]azanium Openeye Name: (4-acetamidophenyl)methyl-[(1S)-1-(2-pyridyl)ethyl]ammonium CAS Name: (4-acetamidophenyl)methyl-[(1S)-1-(2-pyridinyl)ethyl]ammonium IUPAC Name: (4-acetamidophenyl)methyl-[(1S)-1-pyridin-2-ylethyl]azanium Traditional Name: (4-acetamidobenzyl)-[(1S)-1-(2-pyridyl)ethyl]ammonium Formula: C16H20N3O+ MolecularWeight: 270.3495

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=N1)[NH2+]CC2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

C[C@@H](C1=CC=CC=N1)[NH2+]CC2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C16H19N3O/c1-12(16-5-3-4-10-17-16)18-11-14-6-8-15(9-7-14)19-13(2)20/h3-10,12,18H,11H2,1-2H3,(H,19,20)/p+1/t12-/m0/s1