Vitas-M small molecule compound
3-{[(4-chloro-2-nitrophenyl)carbonyl]amino}-3-(4-propoxyphenyl)propanoic acid
Catalog ID
STK685326
SMILES CCCOc1ccc(cc1)C(NC(=O)c1ccc(cc1[N+](=O)[O-])Cl)CC(=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 C19H19ClN2O6 MW 406.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN2O6/c1-2-9-28-14-6-3-12(4-7-14)16(11-18(23)24)21-19(25)15-8-5-13(20)10-17(15)22(26)27/h3-8,10,16H,2,9,11H2,1H3,(H,21,25)(H,23,24)InChIKey
UYGXERJJHHXBGQ-UHFFFAOYSA-NSynonyms
3(((4chloro2nitrophenyl)carbonyl)amino)3(4propoxyphenyl)propanoicacid
3((4CHLORO2NITROBENZOYL)AMINO)3(4PROPOXYPHENYL)PROPANOICACID
CCCOC1=CC=C(C=C1)C(CC(=O)O)NC(=O)C2=C(C=C(C=C2)Cl)(N+)(=O)(O)
CCCOc1ccc(cc1)C(NC(=O)c1ccc(cc1(N+)(=O)(O))Cl)CC(=O)O
InChI=1SC19H19ClN2O6c12928146312(4714)16(1118(23)24)2119(25)158513(20)1017(15)22(26)27h381016H2911H21H3(H2125)(H2324)
MFCD05858355
ZINC000004593253
ZINC000004593254
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