methyl 2,5-dihydro-1-benzoxepine-7-carboxylate

Systemtic Name: methyl 2,5-dihydro-1-benzoxepine-7-carboxylate Openeye Name: methyl 2,5-dihydro-1-benzoxepine-7-carboxylate CAS Name: 2,5-dihydro-1-benzoxepin-7-carboxylic acid methyl ester IUPAC Name: methyl 2,5-dihydro-1-benzoxepine-7-carboxylate Traditional Name: 2,5-dihydro-1-benzoxepin-7-carboxylic acid methyl ester Formula: C12H12O3 MolecularWeight: 204.22188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)OCC=CC2

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)OCC=CC2

InChI

InChI=1S/C12H12O3/c1-14-12(13)10-5-6-11-9(8-10)4-2-3-7-15-11/h2-3,5-6,8H,4,7H2,1H3