Vitas-M small molecule compound
4-{(Z)-[1-(furan-2-ylmethyl)-4-(methoxycarbonyl)-5-methyl-2-oxo-1,2-dihydro-3H-pyrrol-3-ylidene]methyl}benzoic acid
Catalog ID
STK160027
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(cc1)C(=O)O)Cc1ccco1
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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 C20H17NO6 MW 367.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO6/c1-12-17(20(25)26-2)16(10-13-5-7-14(8-6-13)19(23)24)18(22)21(12)11-15-4-3-9-27-15/h3-10H,11H2,1-2H3,(H,23,24)/b16-10-InChIKey
FNFKPRUOPAVSKA-YBEGLDIGSA-NSynonyms
4((Z)(1(FURAN2YLMETHYL)4(METHOXYCARBONYL)5METHYL2OXO12DIHYDRO3HPYRROL3YLIDENE)METHYL)BENZOICACID
4((Z)(1(FURAN2YLMETHYL)4METHOXYCARBONYL5METHYL2OXOPYRROL3YLIDENE)METHYL)BENZOICACID
CC1=C(C(=CC2=CC=C(C=C2)C(=O)O)C(=O)N1CC3=CC=CO3)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(cc1)C(=O)O)Cc1ccco1
InChI=1SC20H17NO6c11217(20(25)262)16(10135714(8613)19(23)24)18(22)21(12)11154392715h310H11H212H3(H2324)b1610
MFCD01894080
ZINC000002648272
ZINC2648272
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