1,3-bis[(2R)-3-morpholin-4-ium-4-yl-2-oxidanyl-propyl]quinazoline-2,4-dione

Systemtic Name: 1,3-bis[(2R)-3-morpholin-4-ium-4-yl-2-oxidanyl-propyl]quinazoline-2,4-dione Openeye Name: 1,3-bis[(2R)-2-hydroxy-3-morpholin-4-ium-4-yl-propyl]quinazoline-2,4-dione CAS Name: 1,3-bis[(2R)-2-hydroxy-3-(4-morpholin-4-iumyl)propyl]quinazoline-2,4-dione IUPAC Name: 1,3-bis[(2R)-2-hydroxy-3-morpholin-4-ium-4-ylpropyl]quinazoline-2,4-dione Traditional Name: 1,3-bis[(2R)-2-hydroxy-3-morpholin-4-ium-4-yl-propyl]quinazoline-2,4-quinone Formula: C22H34N4O6+2 MolecularWeight: 450.52856

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(CN2C3=CC=CC=C3C(=O)N(C2=O)CC(C[NH+]4CCOCC4)O)O

Isomeric SMILES

C1COCC[NH+]1C[C@@H](CN2C3=CC=CC=C3C(=O)N(C2=O)C[C@H](C[NH+]4CCOCC4)O)O

InChI

InChI=1S/C22H32N4O6/c27-17(13-23-5-9-31-10-6-23)15-25-20-4-2-1-3-19(20)21(29)26(22(25)30)16-18(28)14-24-7-11-32-12-8-24/h1-4,17-18,27-28H,5-16H2/p+2/t17-,18-/m0/s1