1-adamantyl 4-chloranyl-2-ethyl-2,4-dimethyl-5-[3-methyl-2,5-bis(oxidanylidene)oxolan-3-yl]pentanoate

Systemtic Name: 1-adamantyl 4-chloranyl-2-ethyl-2,4-dimethyl-5-[3-methyl-2,5-bis(oxidanylidene)oxolan-3-yl]pentanoate Openeye Name: 1-adamantyl 4-chloro-2-ethyl-2,4-dimethyl-5-(3-methyl-2,5-dioxo-tetrahydrofuran-3-yl)pentanoate CAS Name: 4-chloro-2-ethyl-2,4-dimethyl-5-(3-methyl-2,5-dioxo-3-oxolanyl)pentanoic acid 1-adamantyl ester IUPAC Name: 1-adamantyl 4-chloro-2-ethyl-2,4-dimethyl-5-(3-methyl-2,5-dioxooxolan-3-yl)pentanoate Traditional Name: 4-chloro-5-(2,5-diketo-3-methyl-tetrahydrofuran-3-yl)-2-ethyl-2,4-dimethyl-valeric acid 1-adamantyl ester Formula: C24H35ClO5 MolecularWeight: 438.9847

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC(C)(CC1(CC(=O)OC1=O)C)Cl)C(=O)OC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCC(C)(CC(C)(CC1(CC(=O)OC1=O)C)Cl)C(=O)OC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C24H35ClO5/c1-5-21(2,13-23(4,25)14-22(3)12-18(26)29-19(22)27)20(28)30-24-9-15-6-16(10-24)8-17(7-15)11-24/h15-17H,5-14H2,1-4H3