8-azabicyclo[3.2.1]octan-3-yl 5-chloranyl-2,2-dimethyl-3H-1-benzofuran-7-carboxylate

Systemtic Name: 8-azabicyclo[3.2.1]octan-3-yl 5-chloranyl-2,2-dimethyl-3H-1-benzofuran-7-carboxylate Openeye Name: 8-azabicyclo[3.2.1]octan-3-yl 5-chloro-2,2-dimethyl-3H-benzofuran-7-carboxylate CAS Name: 5-chloro-2,2-dimethyl-3H-benzofuran-7-carboxylic acid 8-azabicyclo[3.2.1]octan-3-yl ester IUPAC Name: 8-azabicyclo[3.2.1]octan-3-yl 5-chloro-2,2-dimethyl-3H-1-benzofuran-7-carboxylate Traditional Name: 5-chloro-2,2-dimethyl-coumaran-7-carboxylic acid 8-azabicyclo[3.2.1]octan-3-yl ester Formula: C18H22ClNO3 MolecularWeight: 335.82518

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C(=CC(=C2)Cl)C(=O)OC3CC4CCC(C3)N4)C

Isomeric SMILES

CC1(CC2=C(O1)C(=CC(=C2)Cl)C(=O)OC3CC4CCC(C3)N4)C

InChI

InChI=1S/C18H22ClNO3/c1-18(2)9-10-5-11(19)6-15(16(10)23-18)17(21)22-14-7-12-3-4-13(8-14)20-12/h5-6,12-14,20H,3-4,7-9H2,1-2H3