tert-butyl 4-(2,2,4,6,7-pentamethyl-3-piperidin-1-yl-3H-1-benzofuran-5-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(2,2,4,6,7-pentamethyl-3-piperidin-1-yl-3H-1-benzofuran-5-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2,2,4,6,7-pentamethyl-3-(1-piperidyl)-3H-benzofuran-5-yl]piperazine-1-carboxylate CAS Name: 4-[2,2,4,6,7-pentamethyl-3-(1-piperidinyl)-3H-benzofuran-5-yl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2,2,4,6,7-pentamethyl-3-piperidin-1-yl-3H-1-benzofuran-5-yl)piperazine-1-carboxylate Traditional Name: 4-(2,2,4,6,7-pentamethyl-3-piperidino-coumaran-5-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C27H43N3O3 MolecularWeight: 457.64862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C(C(OC2=C1C)(C)C)N3CCCCC3)C)N4CCN(CC4)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C(=C2C(C(OC2=C1C)(C)C)N3CCCCC3)C)N4CCN(CC4)C(=O)OC(C)(C)C

InChI

InChI=1S/C27H43N3O3/c1-18-19(2)23-21(24(27(7,8)32-23)29-12-10-9-11-13-29)20(3)22(18)28-14-16-30(17-15-28)25(31)33-26(4,5)6/h24H,9-17H2,1-8H3