Vitas-M small molecule compound
3-{[(2-carboxycyclohexyl)carbonyl]amino}-4-methylbenzoic acid
Catalog ID
STK424374
SMILES O=C(C1CCCCC1C(=O)O)Nc1cc(ccc1C)C(=O)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 C16H19NO5 MW 305.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19NO5/c1-9-6-7-10(15(19)20)8-13(9)17-14(18)11-4-2-3-5-12(11)16(21)22/h6-8,11-12H,2-5H2,1H3,(H,17,18)(H,19,20)(H,21,22)InChIKey
DRZSTBQWYYZQMP-UHFFFAOYSA-NSynonyms
3(((2carboxycyclohexyl)carbonyl)amino)4methylbenzoicacid
3((2CARBOXYCYCLOHEXANECARBONYL)AMINO)4METHYLBENZOICACID
3((2CARBOXYCYCLOHEXYL)CARBONYLAMINO)4METHYLBENZOICACID
CC1=C(C=C(C=C1)C(=O)O)NC(=O)C2CCCCC2C(=O)O
InChI=1SC16H19NO5c196710(15(19)20)813(9)1714(18)11423512(11)16(21)22h681112H25H21H3(H1718)(H1920)(H2122)
MFCD01576717
ZINC000005094753
ZINC000005094756
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