5-(furan-2-yl)-1-[3-(1H-imidazol-3-ium-3-yl)propyl]-4-(3-methoxyphenyl)carbonyl-pyrrolidine-2,3-dione

Systemtic Name: 5-(furan-2-yl)-1-[3-(1H-imidazol-3-ium-3-yl)propyl]-4-(3-methoxyphenyl)carbonyl-pyrrolidine-2,3-dione Openeye Name: 5-(2-furyl)-1-[3-(1H-imidazol-3-ium-3-yl)propyl]-4-(3-methoxybenzoyl)pyrrolidine-2,3-dione CAS Name: 5-(2-furanyl)-1-[3-(1H-imidazol-3-ium-3-yl)propyl]-4-[(3-methoxyphenyl)-oxomethyl]pyrrolidine-2,3-dione IUPAC Name: 5-(furan-2-yl)-1-[3-(1H-imidazol-3-ium-3-yl)propyl]-4-(3-methoxybenzoyl)pyrrolidine-2,3-dione Traditional Name: 5-(2-furyl)-1-[3-(1H-imidazol-3-ium-3-yl)propyl]-4-m-anisoyl-pyrrolidine-2,3-quinone Formula: C22H22N3O5+ MolecularWeight: 408.42718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)C2C(N(C(=O)C2=O)CCC[N+]3=CNC=C3)C4=CC=CO4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)C2C(N(C(=O)C2=O)CCC[N+]3=CNC=C3)C4=CC=CO4

InChI

InChI=1S/C22H21N3O5/c1-29-16-6-2-5-15(13-16)20(26)18-19(17-7-3-12-30-17)25(22(28)21(18)27)10-4-9-24-11-8-23-14-24/h2-3,5-8,11-14,18-19H,4,9-10H2,1H3/p+1