ethyl 9-oxidanyl-5-oxidanylidene-3,4-dihydro-2H-1-benzoxepine-4-carboxylate

Systemtic Name: ethyl 9-oxidanyl-5-oxidanylidene-3,4-dihydro-2H-1-benzoxepine-4-carboxylate Openeye Name: ethyl 9-hydroxy-5-oxo-3,4-dihydro-2H-1-benzoxepine-4-carboxylate CAS Name: 9-hydroxy-5-oxo-3,4-dihydro-2H-1-benzoxepin-4-carboxylic acid ethyl ester IUPAC Name: ethyl 9-hydroxy-5-oxo-3,4-dihydro-2H-1-benzoxepine-4-carboxylate Traditional Name: 9-hydroxy-5-keto-3,4-dihydro-2H-1-benzoxepin-4-carboxylic acid ethyl ester Formula: C13H14O5 MolecularWeight: 250.24726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCOC2=C(C1=O)C=CC=C2O

Isomeric SMILES

CCOC(=O)C1CCOC2=C(C1=O)C=CC=C2O

InChI

InChI=1S/C13H14O5/c1-2-17-13(16)9-6-7-18-12-8(11(9)15)4-3-5-10(12)14/h3-5,9,14H,2,6-7H2,1H3