1-butoxyethyl 3-(1-butoxyethoxy)adamantane-1-carboxylate

Systemtic Name: 1-butoxyethyl 3-(1-butoxyethoxy)adamantane-1-carboxylate Openeye Name: 1-butoxyethyl 3-(1-butoxyethoxy)adamantane-1-carboxylate CAS Name: 3-(1-butoxyethoxy)-1-adamantanecarboxylic acid 1-butoxyethyl ester IUPAC Name: 1-butoxyethyl 3-(1-butoxyethoxy)adamantane-1-carboxylate Traditional Name: 3-(1-butoxyethoxy)adamantane-1-carboxylic acid 1-butoxyethyl ester Formula: C23H40O5 MolecularWeight: 396.5607

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(C)OC(=O)C12CC3CC(C1)CC(C3)(C2)OC(C)OCCCC

Isomeric SMILES

CCCCOC(C)OC(=O)C12CC3CC(C1)CC(C3)(C2)OC(C)OCCCC

InChI

InChI=1S/C23H40O5/c1-5-7-9-25-17(3)27-21(24)22-12-19-11-20(13-22)15-23(14-19,16-22)28-18(4)26-10-8-6-2/h17-20H,5-16H2,1-4H3