3,5,6-tris(2,6-diethyl-2,3,6-trimethyl-piperidin-4-yl)benzene-1,2,4-tricarboxylate

Systemtic Name: 3,5,6-tris(2,6-diethyl-2,3,6-trimethyl-piperidin-4-yl)benzene-1,2,4-tricarboxylate Openeye Name: 3,5,6-tris(2,6-diethyl-2,3,6-trimethyl-4-piperidyl)benzene-1,2,4-tricarboxylate CAS Name: 3,5,6-tris(2,6-diethyl-2,3,6-trimethyl-4-piperidinyl)benzene-1,2,4-tricarboxylate IUPAC Name: 3,5,6-tris(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)benzene-1,2,4-tricarboxylate Traditional Name: 3,5,6-tris(2,6-diethyl-2,3,6-trimethyl-4-piperidyl)benzene-1,2,4-tricarboxylate Formula: C45H72N3O6-3 MolecularWeight: 751.06968

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(C(C(N1)(C)CC)C)C2=C(C(=C(C(=C2C(=O)[O-])C3CC(NC(C3C)(C)CC)(C)CC)C(=O)[O-])C(=O)[O-])C4CC(NC(C4C)(C)CC)(C)CC)C

Isomeric SMILES

CCC1(CC(C(C(N1)(C)CC)C)C2=C(C(=C(C(=C2C(=O)[O-])C3CC(NC(C3C)(C)CC)(C)CC)C(=O)[O-])C(=O)[O-])C4CC(NC(C4C)(C)CC)(C)CC)C

InChI

InChI=1S/C45H75N3O6/c1-16-40(10)22-28(25(7)43(13,19-4)46-40)31-32(29-23-41(11,17-2)47-44(14,20-5)26(29)8)35(38(51)52)36(39(53)54)33(34(31)37(49)50)30-24-42(12,18-3)48-45(15,21-6)27(30)9/h25-30,46-48H,16-24H2,1-15H3,(H,49,50)(H,51,52)(H,53,54)/p-3