5-(4-hydroxyphenyl)-4-[(4-methylphenyl)-oxidanyl-methylidene]-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione

Systemtic Name: 5-(4-hydroxyphenyl)-4-[(4-methylphenyl)-oxidanyl-methylidene]-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione Openeye Name: 5-(4-hydroxyphenyl)-4-[hydroxy(p-tolyl)methylene]-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione CAS Name: 4-[hydroxy-(4-methylphenyl)methylidene]-5-(4-hydroxyphenyl)-1-(3-pyridin-1-iumylmethyl)pyrrolidine-2,3-dione IUPAC Name: 4-[hydroxy-(4-methylphenyl)methylidene]-5-(4-hydroxyphenyl)-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione Traditional Name: 5-(4-hydroxyphenyl)-4-[hydroxy(p-tolyl)methylene]-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-quinone Formula: C24H21N2O4+ MolecularWeight: 401.43454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CC3=C[NH+]=CC=C3)C4=CC=C(C=C4)O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CC3=C[NH+]=CC=C3)C4=CC=C(C=C4)O)O

InChI

InChI=1S/C24H20N2O4/c1-15-4-6-18(7-5-15)22(28)20-21(17-8-10-19(27)11-9-17)26(24(30)23(20)29)14-16-3-2-12-25-13-16/h2-13,21,27-28H,14H2,1H3/p+1