methyl 3-oxidanylidene-1-benzoxepine-7-carboxylate

Systemtic Name: methyl 3-oxidanylidene-1-benzoxepine-7-carboxylate Openeye Name: methyl 3-oxo-1-benzoxepine-7-carboxylate CAS Name: 3-oxo-1-benzoxepin-7-carboxylic acid methyl ester IUPAC Name: methyl 3-oxo-1-benzoxepine-7-carboxylate Traditional Name: 3-keto-1-benzoxepin-7-carboxylic acid methyl ester Formula: C12H10O4 MolecularWeight: 218.2054

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)OCC(=O)C=C2

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)OCC(=O)C=C2

InChI

InChI=1S/C12H10O4/c1-15-12(14)9-3-5-11-8(6-9)2-4-10(13)7-16-11/h2-6H,7H2,1H3