Vitas-M small molecule compound
3-[(3-ethylphenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STK459644
SMILES CCc1cccc(c1)NC(=O)C1C2C=CC(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 C17H19NO3 MW 285.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19NO3/c1-2-10-4-3-5-13(8-10)18-16(19)14-11-6-7-12(9-11)15(14)17(20)21/h3-8,11-12,14-15H,2,9H2,1H3,(H,18,19)(H,20,21)InChIKey
KRSDANYPYVMUDV-UHFFFAOYSA-NSynonyms
2((3ETHYLPHENYL)CARBAMOYL)BICYCLO(221)HEPT5ENE3CARBOXYLICACID
3((3ethylphenyl)carbamoyl)bicyclo(221)hept5ene2carboxylicacid
3(N(3ETHYLPHENYL)CARBAMOYL)BICYCLO(221)HEPT5ENE2CARBOXYLICACID
CCC1=CC(=CC=C1)NC(=O)C2C3CC(C2C(=O)O)C=C3
InChI=1SC17H19NO3c121043513(810)1816(19)14116712(911)15(14)17(20)21h3811121415H29H21H3(H1819)(H2021)
MFCD01353575
ZINC000102232356
ZINC000239128731
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