6-(hydroxymethyl)-3,4,5a,6-tetrahydro-2H-1,5-benzodioxepine-2-carboxamide

Systemtic Name: 6-(hydroxymethyl)-3,4,5a,6-tetrahydro-2H-1,5-benzodioxepine-2-carboxamide Openeye Name: 6-(hydroxymethyl)-3,4,5a,6-tetrahydro-2H-1,5-benzodioxepine-2-carboxamide CAS Name: 6-(hydroxymethyl)-3,4,5a,6-tetrahydro-2H-1,5-benzodioxepin-2-carboxamide IUPAC Name: 6-(hydroxymethyl)-3,4,5a,6-tetrahydro-2H-1,5-benzodioxepine-2-carboxamide Traditional Name: 6-methylol-3,4,5a,6-tetrahydro-2H-1,5-benzodioxepin-2-carboxamide Formula: C11H15NO4 MolecularWeight: 225.2411

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2C(C=CC=C2OC1C(=O)N)CO

Isomeric SMILES

C1COC2C(C=CC=C2OC1C(=O)N)CO

InChI

InChI=1S/C11H15NO4/c12-11(14)9-4-5-15-10-7(6-13)2-1-3-8(10)16-9/h1-3,7,9-10,13H,4-6H2,(H2,12,14)