methyl 5-[[(5S,7R)-3-chloranyl-1-adamantyl]carbonyloxymethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[(5S,7R)-3-chloranyl-1-adamantyl]carbonyloxymethyl]furan-2-carboxylate Openeye Name: methyl 5-[[(5S,7R)-3-chloroadamantane-1-carbonyl]oxymethyl]furan-2-carboxylate CAS Name: 5-[[[(5S,7R)-3-chloro-1-adamantyl]-oxomethoxy]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[(5S,7R)-3-chloroadamantane-1-carbonyl]oxymethyl]furan-2-carboxylate Traditional Name: 5-[[(5S,7R)-3-chloroadamantane-1-carbonyl]oxymethyl]furan-2-carboxylic acid methyl ester Formula: C18H21ClO5 MolecularWeight: 352.80934

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)COC(=O)C23CC4CC(C2)CC(C4)(C3)Cl

Isomeric SMILES

COC(=O)C1=CC=C(O1)COC(=O)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)Cl

InChI

InChI=1S/C18H21ClO5/c1-22-15(20)14-3-2-13(24-14)9-23-16(21)17-5-11-4-12(6-17)8-18(19,7-11)10-17/h2-3,11-12H,4-10H2,1H3/t11-,12+,17?,18?