dimethyl 3-(2-methoxyphenyl)-3-oxidanyl-2H-1-benzoxepine-4,5-dicarboxylate

Systemtic Name: dimethyl 3-(2-methoxyphenyl)-3-oxidanyl-2H-1-benzoxepine-4,5-dicarboxylate Openeye Name: dimethyl 3-hydroxy-3-(2-methoxyphenyl)-2H-1-benzoxepine-4,5-dicarboxylate CAS Name: 3-hydroxy-3-(2-methoxyphenyl)-2H-1-benzoxepin-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-hydroxy-3-(2-methoxyphenyl)-2H-1-benzoxepine-4,5-dicarboxylate Traditional Name: 3-hydroxy-3-(2-methoxyphenyl)-2H-1-benzoxepin-4,5-dicarboxylic acid dimethyl ester Formula: C21H20O7 MolecularWeight: 384.3793

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2(COC3=CC=CC=C3C(=C2C(=O)OC)C(=O)OC)O

Isomeric SMILES

COC1=CC=CC=C1C2(COC3=CC=CC=C3C(=C2C(=O)OC)C(=O)OC)O

InChI

InChI=1S/C21H20O7/c1-25-16-11-7-5-9-14(16)21(24)12-28-15-10-6-4-8-13(15)17(19(22)26-2)18(21)20(23)27-3/h4-11,24H,12H2,1-3H3