N12,N25-Bis(1,1,3,3-tetramethylbutyl)-2,9,15,22-tetrakis(2,2,6,6-tetramethyl-4-piperidinyl)-2,9,11,13,15,22,24,26,27,28-decaazatricyclo[21.3.1.110,14]octacosa-1(27),10,12,14(28),23,25-hexaene-12,25-diamine

86168-95-8

CAS Name

N¹²,N²⁵-Bis(1,1,3,3-tetramethylbutyl)-2,9,15,22-tetrakis(2,2,6,6-tetramethyl-4-piperidinyl)-2,9,11,13,15,22,24,26,27,28-decaazatricyclo[21.3.1.1^10,14]octacosa-1(27),10,12,14(28),23,25-hexaene-12,25-diamine

Molecular Formula

C₇₀H₁₃₂N₁₆

Molecular Mass

1197.90

Other Names and Identifiers

InChI

InChI=1S/C70H132N16/c1-59(2,3)47-69(23,24)77-53-71-55-75-56(72-53)84(50-41-63(11,12)80-64(13,14)42-50)36-32-28-30-34-38-86(52-45-67(19,20)82-68(21,22)46-52)58-74-54(78-70(25,26)48-60(4,5)6)73-57(76-58)85(51-43-65(15,16)81-66(17,18)44-51)37-33-29-27-31-35-83(55)49-39-61(7,8)79-62(9,10)40-49/h49-52,79-82H,27-48H2,1-26H3,(H,71,72,75,77)(H,73,74,76,78)

InChIKey

InChIKey=QMXSCDIANZDPCU-UHFFFAOYSA-N

SMILES

N(C(CC(C)(C)C)(C)C)C=1N=C2N(CCCCCCN(C=3N=C(N(CCCCCCN(C(=N2)N1)C4CC(C)(C)NC(C)(C)C4)C5CC(C)(C)NC(C)(C)C5)N=C(NC(CC(C)(C)C)(C)C)N3)C6CC(C)(C)NC(C)(C)C6)C7CC(C)(C)NC(C)(C)C7

Canonical SMILES

N=1C(=NC2=NC1N(CCCCCCN(C3=NC(=NC(=N3)N(CCCCCCN2C4CC(NC(C)(C)C4)(C)C)C5CC(NC(C)(C)C5)(C)C)NC(C)(C)CC(C)(C)C)C6CC(NC(C)(C)C6)(C)C)C7CC(NC(C)(C)C7)(C)C)NC(C)(C)CC(C)(C)C

Other Names for this Substance

Deleted or Replaced CAS Registry Numbers

1401998-21-7