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Reference substances

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General information

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Reference substance information

IUPAC name:
Reaction product of 1,1'-[methylenedi(4,1-phenylene)]di(1H-pyrrole-2,5-dione) and 3-aminobenzohydrazide, trimers, comprising two molecules of 1,1'-[methylenedi(4,1-phenylene)]di(1H-pyrrole-2,5-dione) and one molecule of 3-aminobenzohydrazide

Related substances

Identifiers of related substancesopen allclose all
Identifier:
CAS number
Identity:
13676-54-5
Identifier:
CAS number
Identity:
Benzoic acid, 3-​amino-​, hydrazide

Molecular and structural information

Molecular formula:
C49H37N7O9
Molecular weight:
ca. 867.88
SMILES notation:
O=C(C1=CC=CC(NC2C(N(C3=CC=C(CC4=CC=C(N(C(C=C5)=O)C5=O)C=C4)C=C3)C(C2)=O)=O)=C1)NNC6C(N(C(C6)=O)C7=CC=C(C=C7)CC8=CC=C(C=C8)N(C(C=C9)=O)C9=O)=O
InChl:
InChI=1S/C49H37N7O9/c57-41-20-21-42(58)53(41)35-12-4-29(5-13-35)24-31-8-16-37(17-9-31)55-45(61)27-39(48(55)64)50-34-3-1-2-33(26-34)47(63)52-51-40-28-46(62)56(49(40)65)38-18-10-32(11-19-38)25-30-6-14-36(15-7-30)54-43(59)22-23-44(54)60/h1-23,26,39-40,50-51H,24-25,27-28H2,(H,52,63)
Structural formula:
Chemical structure