(5R)-4-[(4-methylphenyl)-oxidanyl-methylidene]-1-(2-morpholin-4-ium-4-ylethyl)-5-pyridin-2-yl-pyrrolidine-2,3-dione

Systemtic Name: (5R)-4-[(4-methylphenyl)-oxidanyl-methylidene]-1-(2-morpholin-4-ium-4-ylethyl)-5-pyridin-2-yl-pyrrolidine-2,3-dione Openeye Name: (5R)-4-[hydroxy(p-tolyl)methylene]-1-(2-morpholin-4-ium-4-ylethyl)-5-(2-pyridyl)pyrrolidine-2,3-dione CAS Name: (5R)-4-[hydroxy-(4-methylphenyl)methylidene]-1-[2-(4-morpholin-4-iumyl)ethyl]-5-(2-pyridinyl)pyrrolidine-2,3-dione IUPAC Name: (5R)-4-[hydroxy-(4-methylphenyl)methylidene]-1-(2-morpholin-4-ium-4-ylethyl)-5-pyridin-2-ylpyrrolidine-2,3-dione Traditional Name: (5R)-4-[hydroxy(p-tolyl)methylene]-1-(2-morpholin-4-ium-4-ylethyl)-5-(2-pyridyl)pyrrolidine-2,3-quinone Formula: C23H26N3O4+ MolecularWeight: 408.47024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CC[NH+]3CCOCC3)C4=CC=CC=N4)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=C2[C@@H](N(C(=O)C2=O)CC[NH+]3CCOCC3)C4=CC=CC=N4)O

InChI

InChI=1S/C23H25N3O4/c1-16-5-7-17(8-6-16)21(27)19-20(18-4-2-3-9-24-18)26(23(29)22(19)28)11-10-25-12-14-30-15-13-25/h2-9,20,27H,10-15H2,1H3/p+1/t20-/m0/s1