Chem
J-GLOBAL ID:201707009694679277
Nikkaji number:J3.666.608K
3-(9,3′:6′,9′′-Ter[9H-carbazole]-9′-yl)-9H-xanthene-9-one
3-(9,3′:6′,9′′-テル[9H-カルバゾール]-9′-イル)-9H-キサンテン-9-オン
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C49 H29 N3 O2
Molecular formula furigana:
C49-H29-N3-O2
Molecular weight:
691.790
InChI:
InChI=1S/C49H29N3O2/c53-49-37-15-5-10-20-47(37)54-48-29-32(21-24-38(48)49)52-45-25-22-30(50-41-16-6-1-11-33(41)34-12-2-7-17-42(34)50)27-39(45)40-28-31(23-26-46(40)52)51-43-18-8-3-13-35(43)36-14-4-9-19-44(36)51/h1-29H
InChI key:
YNNYPYHWNPBCOH-UHFFFAOYSA-N
SMILES:
O=c1c2ccccc2oc2cc(ccc12)n1c2ccc(cc2c2cc(ccc12)n1c2ccccc2c2ccccc12)n1c2ccccc2c2ccccc12
Systematic name (3):
3-(9,3′:6′,9′′-テル[9H-カルバゾール]-9′-イル)-9H-キサンテン-9-オン
3-[6-(9H-カルバゾール-9-イル)-9H-[3,9'-ビカルバゾール]-9-イル]-9H-キサンテン-9-オン
3-[6-(9H-carbazol-9-yl)-9H-[3,9'-bicarbazol]-9-yl]-9H-xanthen-9-one
Other name (1):
3-(9,3′:6′,9′′-Ter[9H-carbazole]-9′-yl)-9H-xanthene-9-one
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