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

Systemtic Name: 7-bromanyl-3,5-bis(morpholin-4-ylmethyl)-2-oxidanyl-cyclohepta-2,4,6-trien-1-one Openeye Name: 7-bromo-2-hydroxy-3,5-bis(morpholinomethyl)cyclohepta-2,4,6-trien-1-one CAS Name: 7-bromo-2-hydroxy-3,5-bis(4-morpholinylmethyl)-1-cyclohepta-2,4,6-trienone IUPAC Name: 7-bromo-2-hydroxy-3,5-bis(morpholin-4-ylmethyl)cyclohepta-2,4,6-trien-1-one Traditional Name: 7-bromo-2-hydroxy-3,5-bis(morpholinomethyl)cyclohepta-2,4,6-trien-1-one Formula: C17H23BrN2O4 MolecularWeight: 399.27952

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=CC(=C(C(=O)C(=C2)Br)O)CN3CCOCC3

Isomeric SMILES

C1COCCN1CC2=CC(=C(C(=O)C(=C2)Br)O)CN3CCOCC3

InChI

InChI=1S/C17H23BrN2O4/c18-15-10-13(11-19-1-5-23-6-2-19)9-14(16(21)17(15)22)12-20-3-7-24-8-4-20/h9-10H,1-8,11-12H2,(H,21,22)