5-(4-hydroxyphenyl)-4-(4-methoxy-3-methyl-phenyl)carbonyl-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione

Systemtic Name: 5-(4-hydroxyphenyl)-4-(4-methoxy-3-methyl-phenyl)carbonyl-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione Openeye Name: 5-(4-hydroxyphenyl)-4-(4-methoxy-3-methyl-benzoyl)-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione CAS Name: 5-(4-hydroxyphenyl)-4-[(4-methoxy-3-methylphenyl)-oxomethyl]-1-(3-pyridin-1-iumylmethyl)pyrrolidine-2,3-dione IUPAC Name: 5-(4-hydroxyphenyl)-4-(4-methoxy-3-methylbenzoyl)-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione Traditional Name: 5-(4-hydroxyphenyl)-4-(4-methoxy-3-methyl-benzoyl)-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-quinone Formula: C25H23N2O5+ MolecularWeight: 431.46052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H22N2O5/c1-15-12-18(7-10-20(15)32-2)23(29)21-22(17-5-8-19(28)9-6-17)27(25(31)24(21)30)14-16-4-3-11-26-13-16/h3-13,21-22,28H,14H2,1-2H3/p+1