[2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl] adamantane-2-carboxylate

Systemtic Name: [2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl] adamantane-2-carboxylate Openeye Name: [2-(5-chloro-2-thienyl)-2-oxo-ethyl] adamantane-2-carboxylate CAS Name: 2-adamantanecarboxylic acid [2-(5-chloro-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-chlorothiophen-2-yl)-2-oxoethyl] adamantane-2-carboxylate Traditional Name: adamantane-2-carboxylic acid [2-(5-chloro-2-thienyl)-2-keto-ethyl] ester Formula: C17H19ClO3S MolecularWeight: 338.84896

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3C(=O)OCC(=O)C4=CC=C(S4)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)C3C(=O)OCC(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C17H19ClO3S/c18-15-2-1-14(22-15)13(19)8-21-17(20)16-11-4-9-3-10(6-11)7-12(16)5-9/h1-2,9-12,16H,3-8H2