methyl 4-methoxybenzo[b][1]benzoxepine-5-carboxylate

Systemtic Name: methyl 4-methoxybenzo[b][1]benzoxepine-5-carboxylate Openeye Name: methyl 4-methoxybenzo[b][1]benzoxepine-5-carboxylate CAS Name: 4-methoxy-5-benzo[b][1]benzoxepincarboxylic acid methyl ester IUPAC Name: methyl 4-methoxybenzo[b][1]benzoxepine-5-carboxylate Traditional Name: 4-methoxybenzo[b][1]benzoxepin-5-carboxylic acid methyl ester Formula: C17H14O4 MolecularWeight: 282.29066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C(=CC3=CC=CC=C3O2)C(=O)OC

Isomeric SMILES

COC1=CC=CC2=C1C(=CC3=CC=CC=C3O2)C(=O)OC

InChI

InChI=1S/C17H14O4/c1-19-14-8-5-9-15-16(14)12(17(18)20-2)10-11-6-3-4-7-13(11)21-15/h3-10H,1-2H3