[1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl] 3-oxidanyladamantane-1-carboxylate

Systemtic Name: [1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl] 3-oxidanyladamantane-1-carboxylate Openeye Name: [1-methyl-2-oxo-2-(2-thienylmethylamino)ethyl] 3-hydroxyadamantane-1-carboxylate CAS Name: 3-hydroxy-1-adamantanecarboxylic acid [1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] 3-hydroxyadamantane-1-carboxylate Traditional Name: 3-hydroxyadamantane-1-carboxylic acid [2-keto-1-methyl-2-(2-thenylamino)ethyl] ester Formula: C19H25NO4S MolecularWeight: 363.4711

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CS1)OC(=O)C23CC4CC(C2)CC(C4)(C3)O

Isomeric SMILES

CC(C(=O)NCC1=CC=CS1)OC(=O)C23CC4CC(C2)CC(C4)(C3)O

InChI

InChI=1S/C19H25NO4S/c1-12(16(21)20-10-15-3-2-4-25-15)24-17(22)18-6-13-5-14(7-18)9-19(23,8-13)11-18/h2-4,12-14,23H,5-11H2,1H3,(H,20,21)