hydron; 4-[(E)-2-(3-hydroxyphenyl)ethenyl]-1,3,6-trimethyl-pyrimidin-3-ium-2-one; sulfate

Systemtic Name: hydron; 4-[(E)-2-(3-hydroxyphenyl)ethenyl]-1,3,6-trimethyl-pyrimidin-3-ium-2-one; sulfate Openeye Name: hydron; 4-[(E)-2-(3-hydroxyphenyl)vinyl]-1,3,6-trimethyl-pyrimidin-3-ium-2-one; sulfate CAS Name: hydron; 4-[(E)-2-(3-hydroxyphenyl)ethenyl]-1,3,6-trimethyl-2-pyrimidin-3-iumone; sulfate IUPAC Name: hydron; 4-[(E)-2-(3-hydroxyphenyl)ethenyl]-1,3,6-trimethylpyrimidin-3-ium-2-one; sulfate Traditional Name: hydron; 4-[(E)-2-(3-hydroxyphenyl)vinyl]-1,3,6-trimethyl-pyrimidin-3-ium-2-one; sulfate Formula: C15H18N2O6S MolecularWeight: 354.37822

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Descriptors Computed from Structure

Canonical SMILES:

[H+].CC1=CC(=[N+](C(=O)N1C)C)C=CC2=CC(=CC=C2)O.[O-]S(=O)(=O)[O-]

Isomeric SMILES

[H+].CC1=CC(=[N+](C(=O)N1C)C)/C=C/C2=CC(=CC=C2)O.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C15H16N2O2.H2O4S/c1-11-9-13(17(3)15(19)16(11)2)8-7-12-5-4-6-14(18)10-12;1-5(2,3)4/h4-10H,1-3H3;(H2,1,2,3,4)/b8-7+;