1-[3-(1H-imidazol-3-ium-3-yl)propyl]-5-phenyl-4-(4-propan-2-yloxyphenyl)carbonyl-pyrrolidine-2,3-dione

Systemtic Name: 1-[3-(1H-imidazol-3-ium-3-yl)propyl]-5-phenyl-4-(4-propan-2-yloxyphenyl)carbonyl-pyrrolidine-2,3-dione Openeye Name: 1-[3-(1H-imidazol-3-ium-3-yl)propyl]-4-(4-isopropoxybenzoyl)-5-phenyl-pyrrolidine-2,3-dione CAS Name: 1-[3-(1H-imidazol-3-ium-3-yl)propyl]-4-[oxo-(4-propan-2-yloxyphenyl)methyl]-5-phenylpyrrolidine-2,3-dione IUPAC Name: 1-[3-(1H-imidazol-3-ium-3-yl)propyl]-5-phenyl-4-(4-propan-2-yloxybenzoyl)pyrrolidine-2,3-dione Traditional Name: 1-[3-(1H-imidazol-3-ium-3-yl)propyl]-4-(4-isopropoxybenzoyl)-5-phenyl-pyrrolidine-2,3-quinone Formula: C26H28N3O4+ MolecularWeight: 446.51822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)C2C(N(C(=O)C2=O)CCC[N+]3=CNC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)C2C(N(C(=O)C2=O)CCC[N+]3=CNC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H27N3O4/c1-18(2)33-21-11-9-20(10-12-21)24(30)22-23(19-7-4-3-5-8-19)29(26(32)25(22)31)15-6-14-28-16-13-27-17-28/h3-5,7-13,16-18,22-23H,6,14-15H2,1-2H3/p+1