1-(2-ethylhexoxy)ethyl 3-[1-(2-ethylhexoxy)ethoxy]adamantane-1-carboxylate

Systemtic Name: 1-(2-ethylhexoxy)ethyl 3-[1-(2-ethylhexoxy)ethoxy]adamantane-1-carboxylate Openeye Name: 1-(2-ethylhexoxy)ethyl 3-[1-(2-ethylhexoxy)ethoxy]adamantane-1-carboxylate CAS Name: 3-[1-(2-ethylhexoxy)ethoxy]-1-adamantanecarboxylic acid 1-(2-ethylhexoxy)ethyl ester IUPAC Name: 1-(2-ethylhexoxy)ethyl 3-[1-(2-ethylhexoxy)ethoxy]adamantane-1-carboxylate Traditional Name: 3-[1-(2-ethylhexoxy)ethoxy]adamantane-1-carboxylic acid 1-(2-ethylhexoxy)ethyl ester Formula: C31H56O5 MolecularWeight: 508.77334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(C)OC(=O)C12CC3CC(C1)CC(C3)(C2)OC(C)OCC(CC)CCCC

Isomeric SMILES

CCCCC(CC)COC(C)OC(=O)C12CC3CC(C1)CC(C3)(C2)OC(C)OCC(CC)CCCC

InChI

InChI=1S/C31H56O5/c1-7-11-13-25(9-3)20-33-23(5)35-29(32)30-16-27-15-28(17-30)19-31(18-27,22-30)36-24(6)34-21-26(10-4)14-12-8-2/h23-28H,7-22H2,1-6H3