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benzoic acid, 4-[[2-(4-methoxyphenyl)-1-oxo-1H-inden-3-yl]amino]-,butyl ester
SpectraBase Compound ID J8Kk3UXQQys
InChI InChI=1S/C27H25NO4/c1-3-4-17-32-27(30)19-9-13-20(14-10-19)28-25-22-7-5-6-8-23(22)26(29)24(25)18-11-15-21(31-2)16-12-18/h5-16,28H,3-4,17H2,1-2H3
InChIKey OESZIVKODCNPPK-UHFFFAOYSA-N
Mol Weight 427.5 g/mol
Molecular Formula C27H25NO4
Exact Mass 427.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EVkPBsHg2dL
Name 4-[[2-(4-methoxyphenyl)-3-oxo-1-indenyl]amino]benzoic acid butyl ester
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Formula C27H25NO4
InChI InChI=1S/C27H25NO4/c1-3-4-17-32-27(30)19-9-13-20(14-10-19)28-25-22-7-5-6-8-23(22)26(29)24(25)18-11-15-21(31-2)16-12-18/h5-16,28H,3-4,17H2,1-2H3
InChIKey OESZIVKODCNPPK-UHFFFAOYSA-N
Molecular Weight 427.500 g/mol
SMILES N(C1=C(C(c2ccccc12)=O)c1ccc(cc1)OC)c1ccc(C(=O)OCCCC)cc1
SPLASH splash10-004i-3941300000-6b74056b96066af71b3f
Synonyms 4-[[3-keto-2-(4-methoxyphenyl)inden-1-yl]amino]benzoic acid butyl ester Butyl 4-[[2-(4-methoxyphenyl)-3-oxidanylidene-inden-1-yl]amino]benzoate Butyl 4-[[2-(4-methoxyphenyl)-3-oxo-inden-1-yl]amino]benzoate Butyl 4-{[2-(4-methoxyphenyl)-1-oxo-1H-inden-3-yl]amino}benzoate
Wiley ID 1464905