Vitas-M small molecule compound
3-({2-[(4-chloro-3-methylphenoxy)acetyl]hydrazinyl}carbonyl)bicyclo[2.2.1]heptane-2-carboxylic acid
Catalog ID
STK429374
SMILES O=C(COc1ccc(c(c1)C)Cl)NNC(=O)C1C2CCC(C1C(=O)O)C2
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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 C18H21ClN2O5 MW 380.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21ClN2O5/c1-9-6-12(4-5-13(9)19)26-8-14(22)20-21-17(23)15-10-2-3-11(7-10)16(15)18(24)25/h4-6,10-11,15-16H,2-3,7-8H2,1H3,(H,20,22)(H,21,23)(H,24,25)InChIKey
ZJHXZAWJJOOHEP-UHFFFAOYSA-NSynonyms
2(((2(4CHLORO3METHYLPHENOXY)ACETYL)AMINO)CARBAMOYL)BICYCLO(221)HEPTANE3CARBOXYLICACID
3((2((4chloro3methylphenoxy)acetyl)hydrazinyl)carbonyl)bicyclo(221)heptane2carboxylicacid
3(N(2(4CHLORO3METHYLPHENOXY)ACETYLAMINO)CARBAMOYL)BICYCLO(221)HEPTANE2CARBOXYLICACID
CC1=C(C=CC(=C1)OCC(=O)NNC(=O)C2C3CCC(C3)C2C(=O)O)Cl
InChI=1SC18H21ClN2O5c19612(4513(9)19)26814(22)202117(23)15102311(710)16(15)18(24)25h4610111516H2378H21H3(H2022)(H2123)(H2425)
MFCD03234142
ZINC000102203607
ZINC000138687645
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