ethyl 4-[(3-acetamido-9-azabicyclo[3.3.1]nonan-9-yl)carbonylamino]benzoate

Systemtic Name: ethyl 4-[(3-acetamido-9-azabicyclo[3.3.1]nonan-9-yl)carbonylamino]benzoate Openeye Name: ethyl 4-[(3-acetamido-9-azabicyclo[3.3.1]nonane-9-carbonyl)amino]benzoate CAS Name: 4-[[(3-acetamido-9-azabicyclo[3.3.1]nonan-9-yl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3-acetamido-9-azabicyclo[3.3.1]nonane-9-carbonyl)amino]benzoate Traditional Name: 4-[(3-acetamido-9-azabicyclo[3.3.1]nonane-9-carbonyl)amino]benzoic acid ethyl ester Formula: C20H27N3O4 MolecularWeight: 373.44608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)N2C3CCCC2CC(C3)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)N2C3CCCC2CC(C3)NC(=O)C

InChI

InChI=1S/C20H27N3O4/c1-3-27-19(25)14-7-9-15(10-8-14)22-20(26)23-17-5-4-6-18(23)12-16(11-17)21-13(2)24/h7-10,16-18H,3-6,11-12H2,1-2H3,(H,21,24)(H,22,26)