(3,5-dimethyl-4-oxidanyl-phenyl)methyl-prop-2-ynyl-azanium

Systemtic Name: (3,5-dimethyl-4-oxidanyl-phenyl)methyl-prop-2-ynyl-azanium Openeye Name: (4-hydroxy-3,5-dimethyl-phenyl)methyl-prop-2-ynyl-ammonium CAS Name: (4-hydroxy-3,5-dimethylphenyl)methyl-prop-2-ynylammonium IUPAC Name: (4-hydroxy-3,5-dimethylphenyl)methyl-prop-2-ynylazanium Traditional Name: (4-hydroxy-3,5-dimethyl-benzyl)-propargyl-ammonium Formula: C12H16NO+ MolecularWeight: 190.26154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C[NH2+]CC#C

Isomeric SMILES

CC1=CC(=CC(=C1O)C)C[NH2+]CC#C

InChI

InChI=1S/C12H15NO/c1-4-5-13-8-11-6-9(2)12(14)10(3)7-11/h1,6-7,13-14H,5,8H2,2-3H3/p+1