1-benzofuran-7-yl 5-azanyl-2,2,6,7,7-pentamethyl-3,5-bis(oxidanyl)octanoate

Systemtic Name: 1-benzofuran-7-yl 5-azanyl-2,2,6,7,7-pentamethyl-3,5-bis(oxidanyl)octanoate Openeye Name: benzofuran-7-yl 5-amino-3,5-dihydroxy-2,2,6,7,7-pentamethyl-octanoate CAS Name: 5-amino-3,5-dihydroxy-2,2,6,7,7-pentamethyloctanoic acid 7-benzofuranyl ester IUPAC Name: 1-benzofuran-7-yl 5-amino-3,5-dihydroxy-2,2,6,7,7-pentamethyloctanoate Traditional Name: 5-amino-3,5-dihydroxy-2,2,6,7,7-pentamethyl-caprylic acid benzofuran-7-yl ester Formula: C21H31NO5 MolecularWeight: 377.47454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C)C)C(CC(C(C)(C)C(=O)OC1=CC=CC2=C1OC=C2)O)(N)O

Isomeric SMILES

CC(C(C)(C)C)C(CC(C(C)(C)C(=O)OC1=CC=CC2=C1OC=C2)O)(N)O

InChI

InChI=1S/C21H31NO5/c1-13(19(2,3)4)21(22,25)12-16(23)20(5,6)18(24)27-15-9-7-8-14-10-11-26-17(14)15/h7-11,13,16,23,25H,12,22H2,1-6H3