3,6-bis(morpholin-4-ylmethyl)-4,5-bis(oxidanyl)cyclohepta-2,4,6-trien-1-one

Systemtic Name: 3,6-bis(morpholin-4-ylmethyl)-4,5-bis(oxidanyl)cyclohepta-2,4,6-trien-1-one Openeye Name: 4,5-dihydroxy-3,6-bis(morpholinomethyl)cyclohepta-2,4,6-trien-1-one CAS Name: 4,5-dihydroxy-3,6-bis(4-morpholinylmethyl)-1-cyclohepta-2,4,6-trienone IUPAC Name: 4,5-dihydroxy-3,6-bis(morpholin-4-ylmethyl)cyclohepta-2,4,6-trien-1-one Traditional Name: 4,5-dihydroxy-3,6-bis(morpholinomethyl)cyclohepta-2,4,6-trien-1-one Formula: C17H24N2O5 MolecularWeight: 336.38286

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=CC(=O)C=C(C(=C2O)O)CN3CCOCC3

Isomeric SMILES

C1COCCN1CC2=CC(=O)C=C(C(=C2O)O)CN3CCOCC3

InChI

InChI=1S/C17H24N2O5/c20-15-9-13(11-18-1-5-23-6-2-18)16(21)17(22)14(10-15)12-19-3-7-24-8-4-19/h9-10,21-22H,1-8,11-12H2