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3-Bromanyl-N-[(Z)-3-[2-(2-methyl-1H-indol-3-yl)ethylamino]-1-(3-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]benzamide
SpectraBase Compound ID PxbkLsIHrt
InChI InChI=1S/C27H23BrN4O4/c1-17-22(23-10-2-3-11-24(23)30-17)12-13-29-27(34)25(15-18-6-4-9-21(14-18)32(35)36)31-26(33)19-7-5-8-20(28)16-19/h2-11,14-16,30H,12-13H2,1H3,(H,29,34)(H,31,33)/b25-15-
InChIKey FFPDGWFVGIOYHU-MYYYXRDXSA-N
Mol Weight 547.41 g/mol
Molecular Formula C27H23BrN4O4
Exact Mass 546.090268 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I5kCQjEUxcM
Name 3-Bromanyl-N-[(Z)-3-[2-(2-methyl-1H-indol-3-yl)ethylamino]-1-(3-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]benzamide
Alternate Name(s) 3-Bromo-N-[(Z)-1-[2-(2-methyl-1H-indol-3-yl)ethylcarbamoyl]-2-(3-nitrophenyl)vinyl]benzamide 3-Bromo-N-[(Z)-3-[2-(2-methyl-1H-indol-3-yl)ethylamino]-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
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Formula C27H23BrN4O4
InChI InChI=1S/C27H23BrN4O4/c1-17-22(23-10-2-3-11-24(23)30-17)12-13-29-27(34)25(15-18-6-4-9-21(14-18)32(35)36)31-26(33)19-7-5-8-20(28)16-19/h2-11,14-16,30H,12-13H2,1H3,(H,29,34)(H,31,33)/b25-15-
InChIKey FFPDGWFVGIOYHU-MYYYXRDXSA-N
Molecular Weight 547.409 g/mol
SMILES [nH]1c2c(c(CCNC(\C(=C\c3cc(N(=O)=O)ccc3)NC(c3cc(Br)ccc3)=O)=O)c1C)cccc2
SPLASH splash10-0006-0900000000-459e2a17542735c39171
Wiley ID 1464738