(3,5-dimethyl-4-oxidanyl-phenyl)methyl-[(1S)-1-pyridin-2-ylethyl]azanium

Systemtic Name: (3,5-dimethyl-4-oxidanyl-phenyl)methyl-[(1S)-1-pyridin-2-ylethyl]azanium Openeye Name: (4-hydroxy-3,5-dimethyl-phenyl)methyl-[(1S)-1-(2-pyridyl)ethyl]ammonium CAS Name: (4-hydroxy-3,5-dimethylphenyl)methyl-[(1S)-1-(2-pyridinyl)ethyl]ammonium IUPAC Name: (4-hydroxy-3,5-dimethylphenyl)methyl-[(1S)-1-pyridin-2-ylethyl]azanium Traditional Name: (4-hydroxy-3,5-dimethyl-benzyl)-[(1S)-1-(2-pyridyl)ethyl]ammonium Formula: C16H21N2O+ MolecularWeight: 257.35074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C[NH2+]C(C)C2=CC=CC=N2

Isomeric SMILES

CC1=CC(=CC(=C1O)C)C[NH2+][C@@H](C)C2=CC=CC=N2

InChI

InChI=1S/C16H20N2O/c1-11-8-14(9-12(2)16(11)19)10-18-13(3)15-6-4-5-7-17-15/h4-9,13,18-19H,10H2,1-3H3/p+1/t13-/m0/s1