Vitas-M small molecule compound
3-[(2,3-dimethylphenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STK442749
SMILES O=C(C1C2C=CC(C1C(=O)O)C2)Nc1cccc(c1C)C
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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/c1-9-4-3-5-13(10(9)2)18-16(19)14-11-6-7-12(8-11)15(14)17(20)21/h3-7,11-12,14-15H,8H2,1-2H3,(H,18,19)(H,20,21)InChIKey
UVRWEVCGAOPWFC-UHFFFAOYSA-NSynonyms
2((23DIMETHYLPHENYL)CARBAMOYL)BICYCLO(221)HEPT5ENE3CARBOXYLICACID
3((23dimethylphenyl)carbamoyl)bicyclo(221)hept5ene2carboxylicacid
3(N(23DIMETHYLPHENYL)CARBAMOYL)BICYCLO(221)HEPT5ENE2CARBOXYLICACID
CC1=C(C(=CC=C1)NC(=O)C2C3CC(C2C(=O)O)C=C3)C
InChI=1SC17H19NO3c1943513(10(9)2)1816(19)14116712(811)15(14)17(20)21h3711121415H8H212H3(H1819)(H2021)
MFCD00762378
ZINC000100320418
ZINC000238937274
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