dimethyl 1,2,5,7-tetrahydrobenzo[d][2]benzoxepine-3,4-dicarboxylate

Systemtic Name: dimethyl 1,2,5,7-tetrahydrobenzo[d][2]benzoxepine-3,4-dicarboxylate Openeye Name: dimethyl 1,2,5,7-tetrahydrobenzo[d][2]benzoxepine-3,4-dicarboxylate CAS Name: 1,2,5,7-tetrahydrobenzo[d][2]benzoxepin-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1,2,5,7-tetrahydrobenzo[d][2]benzoxepine-3,4-dicarboxylate Traditional Name: 1,2,5,7-tetrahydrobenzo[d][2]benzoxepin-3,4-dicarboxylic acid dimethyl ester Formula: C18H18O5 MolecularWeight: 314.33252

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(CC1)C3=CC=CC=C3COC2)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(C2=C(CC1)C3=CC=CC=C3COC2)C(=O)OC

InChI

InChI=1S/C18H18O5/c1-21-17(19)14-8-7-13-12-6-4-3-5-11(12)9-23-10-15(13)16(14)18(20)22-2/h3-6H,7-10H2,1-2H3