3-thia-7-azabicyclo[3.3.1]nonan-9-yl benzoate

Systemtic Name: 3-thia-7-azabicyclo[3.3.1]nonan-9-yl benzoate Openeye Name: 3-thia-7-azabicyclo[3.3.1]nonan-9-yl benzoate CAS Name: benzoic acid 3-thia-7-azabicyclo[3.3.1]nonan-9-yl ester IUPAC Name: 3-thia-7-azabicyclo[3.3.1]nonan-9-yl benzoate Traditional Name: benzoic acid 3-thia-7-azabicyclo[3.3.1]nonan-9-yl ester Formula: C14H17NO2S MolecularWeight: 263.35528

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CSCC(C2OC(=O)C3=CC=CC=C3)CN1

Isomeric SMILES

C1C2CSCC(C2OC(=O)C3=CC=CC=C3)CN1

InChI

InChI=1S/C14H17NO2S/c16-14(10-4-2-1-3-5-10)17-13-11-6-15-7-12(13)9-18-8-11/h1-5,11-13,15H,6-9H2