Vitas-M small molecule compound

2-(dodecanoylamino)-3-(4-methoxy-3-nitrophenyl)propanoate

Catalog ID
STL363071
SMILES CCCCCCCCCCCC(=O)NC(C(=O)[O-])Cc1ccc(c(c1)[N+](=O)[O-])OC

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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 C22H33N2O6 MW 421.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H34N2O6/c1-3-4-5-6-7-8-9-10-11-12-21(25)23-18(22(26)27)15-17-13-14-20(30-2)19(16-17)24(28)29/h13-14,16,18H,3-12,15H2,1-2H3,(H,23,25)(H,26,27)/p-1
InChIKey
XPCBQARLSPQUSM-UHFFFAOYSA-M
Synonyms

2(dodecanoylamino)3(4methoxy3nitrophenyl)propanoate
2DODECANOYLAMINO3(4METHOXY3NITROPHENYL)PROPIONICACIDANION
AMMONIUM2(LAUROYLAMINO)3(4METHOXY3NITROPHENYL)PROPIONATE
ammonium2dodecanamido3(4methoxy3nitrophenyl)propanoate
AMMONIUM3(4METHOXY3NITROPHENYL)2(1OXODODECYLAMINO)PROPANOATE
AZANIUM2(DODECANOYLAMINO)3(4METHOXY3NITROPHENYL)PROPANOATE
CCCCCCCCCCCC(=O)NC(C(=O)(O))Cc1ccc(c(c1)(N+)(=O)(O))OC
CCCCCCCCCCCC(=O)NC(C(=O)(O))Cc1ccc(c(c1)(N+)(=O)(O))OC(NH4+)
CCCCCCCCCCCC(=O)NC(CC1=CC(=C(C=C1)OC)(N+)(=O)(O))C(=O)(O)
InChI=1SC22H34N2O6c1345678910111221(25)2318(22(26)27)1517131420(302)19(1617)24(28)29h13141618H31215H212H3(H2325)(H2627)p1
MFCD01027089
ZINC000017527457
ZINC000017527459

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Available files

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