1-(4-phenyl-3-prop-1-en-2-yl-phenyl)pyrrol-1-ium-2,5-dione chloride

Systemtic Name: 1-(4-phenyl-3-prop-1-en-2-yl-phenyl)pyrrol-1-ium-2,5-dione chloride Openeye Name: 1-(3-isopropenyl-4-phenyl-phenyl)pyrrol-1-ium-2,5-dione chloride CAS Name: 1-[3-(1-methylethenyl)-4-phenylphenyl]pyrrol-1-ium-2,5-dione chloride IUPAC Name: 1-(4-phenyl-3-prop-1-en-2-ylphenyl)pyrrol-1-ium-2,5-dione chloride Traditional Name: 1-(3-isopropenyl-4-phenyl-phenyl)-3-pyrrolin-1-ium-2,5-quinone chloride Formula: C19H16ClNO2 MolecularWeight: 325.78884

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1=C(C=CC(=C1)[NH+]2C(=O)C=CC2=O)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

CC(=C)C1=C(C=CC(=C1)[NH+]2C(=O)C=CC2=O)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C19H15NO2.ClH/c1-13(2)17-12-15(20-18(21)10-11-19(20)22)8-9-16(17)14-6-4-3-5-7-14;/h3-12H,1H2,2H3;1H