methyl 2,5-dihydro-1-benzoxepine-9-carboxylate

Systemtic Name: methyl 2,5-dihydro-1-benzoxepine-9-carboxylate Openeye Name: methyl 2,5-dihydro-1-benzoxepine-9-carboxylate CAS Name: 2,5-dihydro-1-benzoxepin-9-carboxylic acid methyl ester IUPAC Name: methyl 2,5-dihydro-1-benzoxepine-9-carboxylate Traditional Name: 2,5-dihydro-1-benzoxepin-9-carboxylic acid methyl ester Formula: C12H12O3 MolecularWeight: 204.22188

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C(=CC=C1)CC=CCO2

Isomeric SMILES

COC(=O)C1=C2C(=CC=C1)CC=CCO2

InChI

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