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

Systemtic Name: [2-(5-methylthiophen-2-yl)-2-oxidanylidene-ethyl] adamantane-2-carboxylate Openeye Name: [2-(5-methyl-2-thienyl)-2-oxo-ethyl] adamantane-2-carboxylate CAS Name: 2-adamantanecarboxylic acid [2-(5-methyl-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-methylthiophen-2-yl)-2-oxoethyl] adamantane-2-carboxylate Traditional Name: adamantane-2-carboxylic acid [2-keto-2-(5-methyl-2-thienyl)ethyl] ester Formula: C18H22O3S MolecularWeight: 318.43048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)COC(=O)C2C3CC4CC(C3)CC2C4

Isomeric SMILES

CC1=CC=C(S1)C(=O)COC(=O)C2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C18H22O3S/c1-10-2-3-16(22-10)15(19)9-21-18(20)17-13-5-11-4-12(7-13)8-14(17)6-11/h2-3,11-14,17H,4-9H2,1H3