5-(4-methoxyphenyl)-4-(4-methylphenyl)carbonyl-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione

Systemtic Name: 5-(4-methoxyphenyl)-4-(4-methylphenyl)carbonyl-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione Openeye Name: 5-(4-methoxyphenyl)-4-(4-methylbenzoyl)-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione CAS Name: 5-(4-methoxyphenyl)-4-[(4-methylphenyl)-oxomethyl]-1-(3-pyridin-1-iumylmethyl)pyrrolidine-2,3-dione IUPAC Name: 5-(4-methoxyphenyl)-4-(4-methylbenzoyl)-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione Traditional Name: 5-(4-methoxyphenyl)-4-p-toluoyl-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-quinone Formula: C25H23N2O4+ MolecularWeight: 415.46112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H22N2O4/c1-16-5-7-19(8-6-16)23(28)21-22(18-9-11-20(31-2)12-10-18)27(25(30)24(21)29)15-17-4-3-13-26-14-17/h3-14,21-22H,15H2,1-2H3/p+1