Chem
J-GLOBAL ID:200907028325185874
Nikkaji number:J2.668.305J
Rosa-Mor
4-[9-(2-メチルフェニル)-6-モルホリノ-3H-キサンテン-3-イリデン]モルホリニウム
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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:
C28 H29 N[N+]O3
Molecular formula furigana:
C28-H29-N2-O3
Molecular weight:
441.550
InChI:
InChI=1S/C28H29N2O3/c1-20-4-2-3-5-23(20)28-24-8-6-21(29-10-14-31-15-11-29)18-26(24)33-27-19-22(7-9-25(27)28)30-12-16-32-17-13-30/h2-9,18-19H,10-17H2,1H3/q+1
InChI key:
DQPTZIBOKYRCFO-UHFFFAOYSA-N
SMILES:
Cc1ccccc1c1c2ccc(cc2oc2cc(=[N+]3CCOCC3)ccc12)N1CCOCC1
Systematic name (4):
3-(1-オキサ-4-アゾニアシクロヘキサン-4-イリデン)-6-モルホリノ-9-(2-メチルフェニル)-3H-キサンテン
4-[9-(2-メチルフェニル)-6-(モルホリン-4-イル)-3H-キサンテン-3-イリデン]-4λ5 -モルホリン-4-イリウム
4-[9-(2-methylphenyl)-6-(morpholin-4-yl)-3H-xanthen-3-ylidene]-4λ5 -morpholin-4-ylium
4-[9-(2-メチルフェニル)-6-モルホリノ-3H-キサンテン-3-イリデン]モルホリニウム
Other name (2):
3-(1-Oxa-4-azoniacyclohexane-4-ylidene)-6-morpholino-9-(2-methylphenyl)-3H-xanthene
Rosa-Mor
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