Vitas-M small molecule compound

4-{[2-(3-chlorophenyl)ethyl]amino}-4-oxobutanoic acid

Catalog ID
STK433478
SMILES O=C(CCC(=O)O)NCCc1cccc(c1)Cl

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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 C12H14ClNO3 MW 255.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14ClNO3/c13-10-3-1-2-9(8-10)6-7-14-11(15)4-5-12(16)17/h1-3,8H,4-7H2,(H,14,15)(H,16,17)
InChIKey
WNVATQGMCGKEQN-UHFFFAOYSA-N
Synonyms
242134-67-4
242134674
3(N(2(3CHLOROPHENYL)ETHYL)CARBAMOYL)PROPANOICACID
4((2(3chlorophenyl)ethyl)amino)4oxobutanoicacid
4(2(3CHLOROPHENYL)ETHYLAMINO)4OXOBUTANOICACID
C1=CC(=CC(=C1)Cl)CCNC(=O)CCC(=O)O
InChI=1SC12H14ClNO3c13103129(810)671411(15)4512(16)17h138H47H2(H1415)(H1617)
MFCD03381031
ZINC000002114857
ZINC2114857

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Available files

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