ethyl 7-chloranyl-9-methoxy-5-oxidanylidene-3,4-dihydro-2H-1-benzoxepine-4-carboxylate

Systemtic Name: ethyl 7-chloranyl-9-methoxy-5-oxidanylidene-3,4-dihydro-2H-1-benzoxepine-4-carboxylate Openeye Name: ethyl 7-chloro-9-methoxy-5-oxo-3,4-dihydro-2H-1-benzoxepine-4-carboxylate CAS Name: 7-chloro-9-methoxy-5-oxo-3,4-dihydro-2H-1-benzoxepin-4-carboxylic acid ethyl ester IUPAC Name: ethyl 7-chloro-9-methoxy-5-oxo-3,4-dihydro-2H-1-benzoxepine-4-carboxylate Traditional Name: 7-chloro-5-keto-9-methoxy-3,4-dihydro-2H-1-benzoxepin-4-carboxylic acid ethyl ester Formula: C14H15ClO5 MolecularWeight: 298.7189

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCOC2=C(C=C(C=C2C1=O)Cl)OC

Isomeric SMILES

CCOC(=O)C1CCOC2=C(C=C(C=C2C1=O)Cl)OC

InChI

InChI=1S/C14H15ClO5/c1-3-19-14(17)9-4-5-20-13-10(12(9)16)6-8(15)7-11(13)18-2/h6-7,9H,3-5H2,1-2H3