(3-methyl-3-azabicyclo[3.3.1]nonan-9-yl) 3-cyclopentyl-2-oxidanyl-3-thiophen-2-yl-propanoate

Systemtic Name: (3-methyl-3-azabicyclo[3.3.1]nonan-9-yl) 3-cyclopentyl-2-oxidanyl-3-thiophen-2-yl-propanoate Openeye Name: (3-methyl-3-azabicyclo[3.3.1]nonan-9-yl) 3-cyclopentyl-2-hydroxy-3-(2-thienyl)propanoate CAS Name: 3-cyclopentyl-2-hydroxy-3-thiophen-2-ylpropanoic acid (3-methyl-3-azabicyclo[3.3.1]nonan-9-yl) ester IUPAC Name: (3-methyl-3-azabicyclo[3.3.1]nonan-9-yl) 3-cyclopentyl-2-hydroxy-3-thiophen-2-ylpropanoate Traditional Name: 3-cyclopentyl-2-hydroxy-3-(2-thienyl)propionic acid (3-methyl-3-azabicyclo[3.3.1]nonan-9-yl) ester Formula: C21H31NO3S MolecularWeight: 377.54074

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2CCCC(C1)C2OC(=O)C(C(C3CCCC3)C4=CC=CS4)O

Isomeric SMILES

CN1CC2CCCC(C1)C2OC(=O)C(C(C3CCCC3)C4=CC=CS4)O

InChI

InChI=1S/C21H31NO3S/c1-22-12-15-8-4-9-16(13-22)20(15)25-21(24)19(23)18(14-6-2-3-7-14)17-10-5-11-26-17/h5,10-11,14-16,18-20,23H,2-4,6-9,12-13H2,1H3