tert-butyl 5-bromanyl-3-oxidanyl-3-prop-2-enyl-spiro[1-benzofuran-2,4'-piperidine]-1'-carboxylate

Systemtic Name: tert-butyl 5-bromanyl-3-oxidanyl-3-prop-2-enyl-spiro[1-benzofuran-2,4'-piperidine]-1'-carboxylate Openeye Name: tert-butyl 3-allyl-5-bromo-3-hydroxy-spiro[benzofuran-2,4'-piperidine]-1'-carboxylate CAS Name: 5-bromo-3-hydroxy-3-prop-2-enyl-1'-spiro[benzofuran-2,4'-piperidine]carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-bromo-3-hydroxy-3-prop-2-enylspiro[1-benzofuran-2,4'-piperidine]-1'-carboxylate Traditional Name: 3-allyl-5-bromo-3-hydroxy-spiro[coumaran-2,4'-piperidine]-1'-carboxylic acid tert-butyl ester Formula: C20H26BrNO4 MolecularWeight: 424.32874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2(CC1)C(C3=C(O2)C=CC(=C3)Br)(CC=C)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2(CC1)C(C3=C(O2)C=CC(=C3)Br)(CC=C)O

InChI

InChI=1S/C20H26BrNO4/c1-5-8-20(24)15-13-14(21)6-7-16(15)25-19(20)9-11-22(12-10-19)17(23)26-18(2,3)4/h5-7,13,24H,1,8-12H2,2-4H3