Vitas-M small molecule compound
(1S,2R)-2-[(3-methylphenyl)carbamoyl]cyclohexanecarboxylic acid
Catalog ID
STK413371
SMILES O=C([C@@H]1CCCC[C@@H]1C(=O)O)Nc1cccc(c1)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 C15H19NO3 MW 261.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19NO3/c1-10-5-4-6-11(9-10)16-14(17)12-7-2-3-8-13(12)15(18)19/h4-6,9,12-13H,2-3,7-8H2,1H3,(H,16,17)(H,18,19)/t12-,13+/m1/s1InChIKey
GFFMJPWPZMZWDP-OLZOCXBDSA-NSynonyms
(1S2R)2((3METHYLPHENYL)CARBAMOYL)CYCLOHEXANE1CARBOXYLICACID
(1S2R)2((3methylphenyl)carbamoyl)cyclohexanecarboxylicacid
CC1=CC(=CC=C1)NC(=O)C2CCCCC2C(=O)O
InChI=1SC15H19NO3c11054611(910)1614(17)12723813(12)15(18)19h4691213H2378H21H3(H1617)(H1819)t1213+m1s1
MFCD00029470
O=C((C@@H)1CCCC(C@@H)1C(=O)O)Nc1cccc(c1)C
ZINC000000397914
ZINC397914
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