Vitas-M small molecule compound

N~2~-benzyl-N-[2-(methoxycarbonyl)phenyl]-alpha-asparagine

Catalog ID
STK147524
SMILES COC(=O)c1ccccc1NC(=O)C(CC(=O)O)NCc1ccccc1

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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 C19H20N2O5 MW 356.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O5/c1-26-19(25)14-9-5-6-10-15(14)21-18(24)16(11-17(22)23)20-12-13-7-3-2-4-8-13/h2-10,16,20H,11-12H2,1H3,(H,21,24)(H,22,23)
InChIKey
GSBMSYFPHDRQAG-UHFFFAOYSA-N
Synonyms
1022917-20-9
(3R)3(BENZYLAMMONIO)4((2(METHOXYCARBONYL)PHENYL)AMINO)4OXOBUTANOATE
(3S)3(BENZYLAMMONIO)4((2(METHOXYCARBONYL)PHENYL)AMINO)4OXOBUTANOATE
1022917209
3(benzylamino)4((2(methoxycarbonyl)phenyl)amino)4oxobutanoicacid
3(BENZYLAMINO)4(2METHOXYCARBONYLANILINO)4OXOBUTANOICACID
3(BENZYLAMMONIO)4((2(METHOXYCARBONYL)PHENYL)AMINO)4OXOBUTANOATE
3(BENZYLAZANIUMYL)4(2METHOXYCARBONYLANILINO)4OXOBUTANOATE
COC(=O)C1=CC=CC=C1NC(=O)C(CC(=O)O)NCC2=CC=CC=C2
InChI=1SC19H20N2O5c12619(25)149561015(14)2118(24)16(1117(22)23)2012137324813h2101620H1112H21H3(H2124)(H2223)
N~2~benzylN(2(methoxycarbonyl)phenyl)alphaasparagine
N2BENZYLN(2(METHOXYCARBONYL)PHENYL)ALPHAASPARAGINE

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.