3-oxidanyl-6-phenylmethoxy-2,4-dihydro-1,5-benzodioxepine-3-carbonitrile

Systemtic Name: 3-oxidanyl-6-phenylmethoxy-2,4-dihydro-1,5-benzodioxepine-3-carbonitrile Openeye Name: 6-benzyloxy-3-hydroxy-2,4-dihydro-1,5-benzodioxepine-3-carbonitrile CAS Name: 3-hydroxy-6-phenylmethoxy-2,4-dihydro-1,5-benzodioxepin-3-carbonitrile IUPAC Name: 3-hydroxy-6-phenylmethoxy-2,4-dihydro-1,5-benzodioxepine-3-carbonitrile Traditional Name: 6-benzoxy-3-hydroxy-2,4-dihydro-1,5-benzodioxepin-3-carbonitrile Formula: C17H15NO4 MolecularWeight: 297.3053

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Descriptors Computed from Structure

Canonical SMILES:

C1C(COC2=C(O1)C=CC=C2OCC3=CC=CC=C3)(C#N)O

Isomeric SMILES

C1C(COC2=C(O1)C=CC=C2OCC3=CC=CC=C3)(C#N)O

InChI

InChI=1S/C17H15NO4/c18-10-17(19)11-21-15-8-4-7-14(16(15)22-12-17)20-9-13-5-2-1-3-6-13/h1-8,19H,9,11-12H2