[2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl] 3-thiophen-2-ylpropanoate

Systemtic Name: [2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl] 3-thiophen-2-ylpropanoate Openeye Name: [2-(1-adamantylmethylamino)-2-oxo-ethyl] 3-(2-thienyl)propanoate CAS Name: 3-thiophen-2-ylpropanoic acid [2-(1-adamantylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylmethylamino)-2-oxoethyl] 3-thiophen-2-ylpropanoate Traditional Name: 3-(2-thienyl)propionic acid [2-(1-adamantylmethylamino)-2-keto-ethyl] ester Formula: C20H27NO3S MolecularWeight: 361.49828

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)COC(=O)CCC4=CC=CS4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)COC(=O)CCC4=CC=CS4

InChI

InChI=1S/C20H27NO3S/c22-18(12-24-19(23)4-3-17-2-1-5-25-17)21-13-20-9-14-6-15(10-20)8-16(7-14)11-20/h1-2,5,14-16H,3-4,6-13H2,(H,21,22)