1,4-Bis((3-methyl-5-styrylisoxazole-4-ylamino)-(2-bromophenyl)methyl)naphthalene - 2, 3-diol - Optional[MS (GC)] - Spectrum

SpectraBase Compound ID	1guY806nW9J
InChI	InChI=1S/C48H38Br2N4O4/c1-29-43(39(57-53-29)27-25-31-15-5-3-6-16-31)51-45(35-21-11-13-23-37(35)49)41-33-19-9-10-20-34(33)42(48(56)47(41)55)46(36-22-12-14-24-38(36)50)52-44-30(2)54-58-40(44)28-26-32-17-7-4-8-18-32/h3-28,45-46,51-52,55-56H,1-2H3/b27-25+,28-26+
InChIKey	UUPMEYLKCJNVEA-NBHCHVEOSA-N Google Search
Mol Weight	894.7 g/mol
Molecular Formula	C48H38Br2N4O4
Exact Mass	892.125982 g/mol

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SpectraBase Spectrum ID	2MGJhhoa5bQ
Name	1,4-Bis((3-methyl-5-styrylisoxazole-4-ylamino)-(2-bromophenyl)methyl)naphthalene - 2, 3-diol
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C48H38Br2N4O4
InChI	InChI=1S/C48H38Br2N4O4/c1-29-43(39(57-53-29)27-25-31-15-5-3-6-16-31)51-45(35-21-11-13-23-37(35)49)41-33-19-9-10-20-34(33)42(48(56)47(41)55)46(36-22-12-14-24-38(36)50)52-44-30(2)54-58-40(44)28-26-32-17-7-4-8-18-32/h3-28,45-46,51-52,55-56H,1-2H3/b27-25+,28-26+
InChIKey	UUPMEYLKCJNVEA-NBHCHVEOSA-N
Molecular Weight	894.664 g/mol
SMILES	N(c1c(onc1C)\C=C\c1ccccc1)C(c1c2c(c(c(c1O)O)C(Nc1c(onc1C)\C=C\c1ccccc1)c1c(cccc1)Br)cccc2)c1c(cccc1)Br
SPLASH	splash10-0ikc-0101310290-db15f1047613735e49c4
Source of Spectrum	Y1-53B-416-4h
Synonyms	1,4-Bis((2-bromophenyl)((3-methyl-5-((E)-styryl)isoxazol-4-yl)amino)methyl)naphthalene-2,3-diol
Wiley ID	1743620