4-ethoxycarbonyl-2,3-dihydro-1-benzoxepine-9-carboxylic acid

Systemtic Name: 4-ethoxycarbonyl-2,3-dihydro-1-benzoxepine-9-carboxylic acid Openeye Name: 4-ethoxycarbonyl-2,3-dihydro-1-benzoxepine-9-carboxylic acid CAS Name: 4-ethoxycarbonyl-2,3-dihydro-1-benzoxepin-9-carboxylic acid IUPAC Name: 4-ethoxycarbonyl-2,3-dihydro-1-benzoxepine-9-carboxylic acid Traditional Name: 4-carbethoxy-2,3-dihydro-1-benzoxepin-9-carboxylic acid Formula: C14H14O5 MolecularWeight: 262.25796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C(=CC=C2)C(=O)O)OCC1

Isomeric SMILES

CCOC(=O)C1=CC2=C(C(=CC=C2)C(=O)O)OCC1

InChI

InChI=1S/C14H14O5/c1-2-18-14(17)10-6-7-19-12-9(8-10)4-3-5-11(12)13(15)16/h3-5,8H,2,6-7H2,1H3,(H,15,16)