Vitas-M small molecule compound

3-[(2-fluorophenyl)carbamoyl]spiro[bicyclo[2.2.1]heptane-7,1'-cyclopropane]-5-ene-2-carboxylic acid

Catalog ID
STK523407
SMILES O=C(C1C(C(=O)O)C2C3(C1C=C2)CC3)Nc1ccccc1F

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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 C17H16FNO3 MW 301.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16FNO3/c18-11-3-1-2-4-12(11)19-15(20)13-9-5-6-10(14(13)16(21)22)17(9)7-8-17/h1-6,9-10,13-14H,7-8H2,(H,19,20)(H,21,22)
InChIKey
AJOZMNVJNWXRBZ-UHFFFAOYSA-N
Synonyms

2((2FLUOROPHENYL)CARBAMOYL)SPIRO(BICYCLO(221)HEPT5ENE71CYCLOPROPANE)3CARBOXYLICACID
3((2FLUOROPHENYL)CARBAMOYL)SPIRO(BICYCLO(221)HEPTANE71CYCLOPROPANE)5ENE2CARBOXYLICACID
C1CC12C3C=CC2C(C3C(=O)NC4=CC=CC=C4F)C(=O)O
InChI=1SC17H16FNO3c1811312412(11)1915(20)1395610(14(13)16(21)22)17(9)7817h169101314H78H2(H1920)(H2122)
MFCD01187856
ZINC000102987594
ZINC000102987603

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.