Vitas-M small molecule compound
3-{[(2E)-3-carboxyprop-2-enoyl]amino}-4-chlorobenzoic acid
Catalog ID
STL388016
SMILES OC(=O)/C=C/C(=O)Nc1cc(ccc1Cl)C(=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 C11H8ClNO5 MW 269.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H8ClNO5/c12-7-2-1-6(11(17)18)5-8(7)13-9(14)3-4-10(15)16/h1-5H,(H,13,14)(H,15,16)(H,17,18)/b4-3+InChIKey
KVMFXHRQSIDONN-ONEGZZNKSA-NSynonyms
1049157-75-61049157756
3(((2E)3carboxyprop2enoyl)amino)4chlorobenzoicacid
3(((E)3carboxyprop2enoyl)amino)4chlorobenzoicacid
3((3CARBOXYACRYLOYL)AMINO)4CHLOROBENZOICACID
C1=CC(=C(C=C1C(=O)O)NC(=O)C=CC(=O)O)Cl
InChI=1SC11H8ClNO5c127216(11(17)18)58(7)139(14)3410(15)16h15H(H1314)(H1516)(H1718)b43+
MFCD12022116
OC(=O)C=CC(=O)Nc1cc(ccc1Cl)C(=O)O
ZINC000035316205
ZINC35316205
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