Vitas-M small molecule compound
3-[(3-hydroxy-2H-1,4-benzoxazin-7-yl)carbamoyl]-2,2-dimethylcyclopropanecarboxylic acid
Catalog ID
STL250376
SMILES O=C(C1C(C1(C)C)C(=O)O)Nc1ccc2c(c1)OCC(=N2)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 C15H16N2O5 MW 304.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N2O5/c1-15(2)11(12(15)14(20)21)13(19)16-7-3-4-8-9(5-7)22-6-10(18)17-8/h3-5,11-12H,6H2,1-2H3,(H,16,19)(H,17,18)(H,20,21)InChIKey
HTLGGZBODHPFSC-UHFFFAOYSA-NSynonyms
1324076-24-51324076245
22dimethyl3((3oxo4H14benzoxazin7yl)carbamoyl)cyclopropane1carboxylicacid
3((3hydroxy2H14benzoxazin7yl)carbamoyl)22dimethylcyclopropanecarboxylicacid
CC1(C(C1C(=O)O)C(=O)NC2=CC3=C(C=C2)NC(=O)CO3)C
InChI=1SC15H16N2O5c115(2)11(12(15)14(20)21)13(19)1673489(57)22610(18)178h351112H6H212H3(H1619)(H1718)(H2021)
MFCD24852327
ZINC000071286302
ZINC000071286308
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