(2-methyl-4-phenyl-hex-5-en-2-yl)azanium; methyl sulfate

Systemtic Name: (2-methyl-4-phenyl-hex-5-en-2-yl)azanium; methyl sulfate Openeye Name: (1,1-dimethyl-3-phenyl-pent-4-enyl)ammonium; methyl sulfate CAS Name: (2-methyl-4-phenylhex-5-en-2-yl)ammonium; methyl sulfate IUPAC Name: (2-methyl-4-phenylhex-5-en-2-yl)azanium; methyl sulfate Traditional Name: (1,1-dimethyl-3-phenyl-pent-4-enyl)ammonium; methyl sulfate Formula: C14H23NO4S MolecularWeight: 301.40172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(C=C)C1=CC=CC=C1)[NH3+].COS(=O)(=O)[O-]

Isomeric SMILES

CC(C)(CC(C=C)C1=CC=CC=C1)[NH3+].COS(=O)(=O)[O-]

InChI

InChI=1S/C13H19N.CH4O4S/c1-4-11(10-13(2,3)14)12-8-6-5-7-9-12;1-5-6(2,3)4/h4-9,11H,1,10,14H2,2-3H3;1H3,(H,2,3,4)