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Details

Stereochemistry ACHIRAL
Molecular Formula C50H30N4O8
Molecular Weight 814.7952
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N1,N4-Bis[5-(benzoylamino)-9,10-dihydro-9,10-dioxo-1-anthracenyl]-1,4-benzenedicarboxamide

SMILES

O=C(NC1=CC=CC2=C1C(=O)C3=CC=CC(NC(=O)C4=CC=CC=C4)=C3C2=O)C5=CC=C(C=C5)C(=O)NC6=C7C(=O)C8=CC=CC(NC(=O)C9=CC=CC=C9)=C8C(=O)C7=CC=C6

InChI

InChIKey=KGZMABLDPNAGFQ-UHFFFAOYSA-N
InChI=1S/C50H30N4O8/c55-43-33-17-9-21-37(41(33)45(57)31-15-7-19-35(39(31)43)51-47(59)27-11-3-1-4-12-27)53-49(61)29-23-25-30(26-24-29)50(62)54-38-22-10-18-34-42(38)46(58)32-16-8-20-36(40(32)44(34)56)52-48(60)28-13-5-2-6-14-28/h1-26H,(H,51,59)(H,52,60)(H,53,61)(H,54,62)

HIDE SMILES / InChI

Molecular Formula C50H30N4O8
Molecular Weight 814.7952
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
VE5NA4G4NM
Record Status Validated (UNII)
Record Version