4,6-bis[(E)-2-(3-hydroxyphenyl)ethenyl]-1,3-dimethyl-pyrimidin-1-ium-2-one

Systemtic Name: 4,6-bis[(E)-2-(3-hydroxyphenyl)ethenyl]-1,3-dimethyl-pyrimidin-1-ium-2-one Openeye Name: 4,6-bis[(E)-2-(3-hydroxyphenyl)vinyl]-1,3-dimethyl-pyrimidin-1-ium-2-one CAS Name: 4,6-bis[(E)-2-(3-hydroxyphenyl)ethenyl]-1,3-dimethyl-2-pyrimidin-1-iumone IUPAC Name: 4,6-bis[(E)-2-(3-hydroxyphenyl)ethenyl]-1,3-dimethylpyrimidin-1-ium-2-one Traditional Name: 4,6-bis[(E)-2-(3-hydroxyphenyl)vinyl]-1,3-dimethyl-pyrimidin-1-ium-2-one Formula: C22H21N2O3+ MolecularWeight: 361.41374

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=[N+](C1=O)C)C=CC2=CC(=CC=C2)O)C=CC3=CC(=CC=C3)O

Isomeric SMILES

CN1C(=CC(=[N+](C1=O)C)/C=C/C2=CC(=CC=C2)O)/C=C/C3=CC(=CC=C3)O

InChI

InChI=1S/C22H20N2O3/c1-23-18(11-9-16-5-3-7-20(25)13-16)15-19(24(2)22(23)27)12-10-17-6-4-8-21(26)14-17/h3-15H,1-2H3,(H-,25,26)/p+1/b11-9+,12-10+