Methyl (2S)-2-[(benzyloxycarbonyl)amino]-3-[5'-(4''-nitrophenyl)-1'-phenyl-1'H-pyrazol-3'-yl]propanoate

SpectraBase Compound ID	Ll6I0wOTqMr
InChI	InChI=1S/C27H24N4O6/c1-36-26(32)24(28-27(33)37-18-19-8-4-2-5-9-19)16-21-17-25(20-12-14-23(15-13-20)31(34)35)30(29-21)22-10-6-3-7-11-22/h2-15,17,24H,16,18H2,1H3,(H,28,33)/t24-/m0/s1
InChIKey	IHHAWRYHUFHCHW-DEOSSOPVSA-N Google Search
Mol Weight	500.51 g/mol
Molecular Formula	C27H24N4O6
Exact Mass	500.169585 g/mol

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SpectraBase Spectrum ID	Ll3dIgXfhSi
Name	Methyl (2S)-2-[(benzyloxycarbonyl)amino]-3-[5'-(4''-nitrophenyl)-1'-phenyl-1'H-pyrazol-3'-yl]propanoate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C27H24N4O6
InChI	InChI=1S/C27H24N4O6/c1-36-26(32)24(28-27(33)37-18-19-8-4-2-5-9-19)16-21-17-25(20-12-14-23(15-13-20)31(34)35)30(29-21)22-10-6-3-7-11-22/h2-15,17,24H,16,18H2,1H3,(H,28,33)/t24-/m0/s1
InChIKey	IHHAWRYHUFHCHW-DEOSSOPVSA-N
Molecular Weight	500.511 g/mol
SMILES	N(C(OCc1ccccc1)=O)[C@](C(OC)=O)(Cc1n[n](c(c1)-c1ccc([N+](=O)[O-])cc1)-c1ccccc1)[H]
SPLASH	splash10-002e-3079000000-3ce48bac9de3329817fd
Source of Spectrum	F5-13-4519-18
Synonyms	(S)-methyl 2-(((benzyloxy)carbonyl)amino)-3-(5-(4-nitrophenyl)-1-phenyl-1H-pyrazol-3-yl)propanoate
Wiley ID	1760850