5,5-dimethyl-4-(4-methylphenyl)-1,4-bis(oxidanyl)-2-phenyl-pyrrol-1-ium-3-one

Systemtic Name: 5,5-dimethyl-4-(4-methylphenyl)-1,4-bis(oxidanyl)-2-phenyl-pyrrol-1-ium-3-one Openeye Name: 1,4-dihydroxy-5,5-dimethyl-2-phenyl-4-(p-tolyl)pyrrol-1-ium-3-one CAS Name: 1,4-dihydroxy-5,5-dimethyl-4-(4-methylphenyl)-2-phenyl-3-pyrrol-1-iumone IUPAC Name: 1,4-dihydroxy-5,5-dimethyl-4-(4-methylphenyl)-2-phenylpyrrol-1-ium-3-one Traditional Name: 1,4-dihydroxy-5,5-dimethyl-2-phenyl-4-(p-tolyl)-1-pyrrolin-1-ium-3-one Formula: C19H20NO3+ MolecularWeight: 310.367

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(C(=O)C(=[N+](C2(C)C)O)C3=CC=CC=C3)O

Isomeric SMILES

CC1=CC=C(C=C1)C2(C(=O)C(=[N+](C2(C)C)O)C3=CC=CC=C3)O

InChI

InChI=1S/C19H20NO3/c1-13-9-11-15(12-10-13)19(22)17(21)16(20(23)18(19,2)3)14-7-5-4-6-8-14/h4-12,22-23H,1-3H3/q+1