methyl 2-[(3-acetamido-9-azabicyclo[3.3.1]nonan-9-yl)sulfonyl]benzoate

Systemtic Name: methyl 2-[(3-acetamido-9-azabicyclo[3.3.1]nonan-9-yl)sulfonyl]benzoate Openeye Name: methyl 2-[(3-acetamido-9-azabicyclo[3.3.1]nonan-9-yl)sulfonyl]benzoate CAS Name: 2-[(3-acetamido-9-azabicyclo[3.3.1]nonan-9-yl)sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(3-acetamido-9-azabicyclo[3.3.1]nonan-9-yl)sulfonyl]benzoate Traditional Name: 2-[(3-acetamido-9-azabicyclo[3.3.1]nonan-9-yl)sulfonyl]benzoic acid methyl ester Formula: C18H24N2O5S MolecularWeight: 380.45856

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CC2CCCC(C1)N2S(=O)(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC(=O)NC1CC2CCCC(C1)N2S(=O)(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C18H24N2O5S/c1-12(21)19-13-10-14-6-5-7-15(11-13)20(14)26(23,24)17-9-4-3-8-16(17)18(22)25-2/h3-4,8-9,13-15H,5-7,10-11H2,1-2H3,(H,19,21)