Vitas-M small molecule compound

3,4-bis{[(3-nitrophenoxy)acetyl]amino}benzoic acid

Catalog ID
STK299801
SMILES O=C(Nc1cc(ccc1NC(=O)COc1cccc(c1)[N+](=O)[O-])C(=O)O)COc1cccc(c1)[N+](=O)[O-]

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C23H18N4O10 MW 510.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N4O10/c28-21(12-36-17-5-1-3-15(10-17)26(32)33)24-19-8-7-14(23(30)31)9-20(19)25-22(29)13-37-18-6-2-4-16(11-18)27(34)35/h1-11H,12-13H2,(H,24,28)(H,25,29)(H,30,31)
InChIKey
BGCZYSYHSLTPHR-UHFFFAOYSA-N
Synonyms
667403-70-5
34bis(((3nitrophenoxy)acetyl)amino)benzoicacid
34BIS((2(3NITROPHENOXY)ACETYL)AMINO)BENZOICACID
34bis(2(3nitrophenoxy)acetamido)benzoicacid
667403705
C1=CC(=CC(=C1)OCC(=O)NC2=C(C=C(C=C2)C(=O)O)NC(=O)COC3=CC=CC(=C3)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC23H18N4O10c2821(12361751315(1017)26(32)33)24198714(23(30)31)920(19)2522(29)13371862416(1118)27(34)35h111H1213H2(H2428)(H2529)(H3031)
MFCD01974676
O=C(Nc1cc(ccc1NC(=O)COc1cccc(c1)(N+)(=O)(O))C(=O)O)COc1cccc(c1)(N+)(=O)(O)
ZINC000009360453
ZINC9360453

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Available files

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