ethyl 8-oxidanyl-2,3,4,5-tetrahydro-1-benzoxepine-4-carboxylate

Systemtic Name: ethyl 8-oxidanyl-2,3,4,5-tetrahydro-1-benzoxepine-4-carboxylate Openeye Name: ethyl 8-hydroxy-2,3,4,5-tetrahydro-1-benzoxepine-4-carboxylate CAS Name: 8-hydroxy-2,3,4,5-tetrahydro-1-benzoxepin-4-carboxylic acid ethyl ester IUPAC Name: ethyl 8-hydroxy-2,3,4,5-tetrahydro-1-benzoxepine-4-carboxylate Traditional Name: 8-hydroxy-2,3,4,5-tetrahydro-1-benzoxepin-4-carboxylic acid ethyl ester Formula: C13H16O4 MolecularWeight: 236.26374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCOC2=C(C1)C=CC(=C2)O

Isomeric SMILES

CCOC(=O)C1CCOC2=C(C1)C=CC(=C2)O

InChI

InChI=1S/C13H16O4/c1-2-16-13(15)10-5-6-17-12-8-11(14)4-3-9(12)7-10/h3-4,8,10,14H,2,5-7H2,1H3