3,3-bis(hydroxymethyl)-8a-methoxy-5-(phenylcarbonyl)-2,4-dihydro-1,4-benzoxazin-8-one

Systemtic Name: 3,3-bis(hydroxymethyl)-8a-methoxy-5-(phenylcarbonyl)-2,4-dihydro-1,4-benzoxazin-8-one Openeye Name: 5-benzoyl-3,3-bis(hydroxymethyl)-8a-methoxy-2,4-dihydro-1,4-benzoxazin-8-one CAS Name: 5-benzoyl-3,3-bis(hydroxymethyl)-8a-methoxy-2,4-dihydro-1,4-benzoxazin-8-one IUPAC Name: 5-benzoyl-3,3-bis(hydroxymethyl)-8a-methoxy-2,4-dihydro-1,4-benzoxazin-8-one Traditional Name: 5-benzoyl-8a-methoxy-3,3-dimethylol-2,4-dihydro-1,4-benzoxazin-8-one Formula: C18H19NO6 MolecularWeight: 345.34656

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Descriptors Computed from Structure

Canonical SMILES:

COC12C(=O)C=CC(=C1NC(CO2)(CO)CO)C(=O)C3=CC=CC=C3

Isomeric SMILES

COC12C(=O)C=CC(=C1NC(CO2)(CO)CO)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H19NO6/c1-24-18-14(22)8-7-13(15(23)12-5-3-2-4-6-12)16(18)19-17(9-20,10-21)11-25-18/h2-8,19-21H,9-11H2,1H3