dimethyl 5-[3-[3,5-bis(methoxycarbonyl)phenyl]-1-adamantyl]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[3-[3,5-bis(methoxycarbonyl)phenyl]-1-adamantyl]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[3-[3,5-bis(methoxycarbonyl)phenyl]-1-adamantyl]benzene-1,3-dicarboxylate CAS Name: 5-[3-[3,5-bis(methoxycarbonyl)phenyl]-1-adamantyl]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[3-[3,5-bis(methoxycarbonyl)phenyl]-1-adamantyl]benzene-1,3-dicarboxylate Traditional Name: 5-[3-(3,5-dicarbomethoxyphenyl)-1-adamantyl]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C30H32O8 MolecularWeight: 520.57028

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C23CC4CC(C2)CC(C4)(C3)C5=CC(=CC(=C5)C(=O)OC)C(=O)OC)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C23CC4CC(C2)CC(C4)(C3)C5=CC(=CC(=C5)C(=O)OC)C(=O)OC)C(=O)OC

InChI

InChI=1S/C30H32O8/c1-35-25(31)19-6-20(26(32)36-2)9-23(8-19)29-12-17-5-18(13-29)15-30(14-17,16-29)24-10-21(27(33)37-3)7-22(11-24)28(34)38-4/h6-11,17-18H,5,12-16H2,1-4H3