Vitas-M small molecule compound
6-{[1-(3,4-dimethylphenyl)ethyl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK479254
SMILES O=C(C1CC=CCC1C(=O)O)NC(c1ccc(c(c1)C)C)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 C18H23NO3 MW 301.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23NO3/c1-11-8-9-14(10-12(11)2)13(3)19-17(20)15-6-4-5-7-16(15)18(21)22/h4-5,8-10,13,15-16H,6-7H2,1-3H3,(H,19,20)(H,21,22)InChIKey
MJSKIYANFCWTMW-UHFFFAOYSA-NSynonyms
6((1(34dimethylphenyl)ethyl)carbamoyl)cyclohex3ene1carboxylicacid
6(1(34dimethylphenyl)ethylcarbamoyl)cyclohex3ene1carboxylicacid
6(N((34DIMETHYLPHENYL)ETHYL)CARBAMOYL)CYCLOHEX3ENECARBOXYLICACID
CC1=C(C=C(C=C1)C(C)NC(=O)C2CC=CCC2C(=O)O)C
InChI=1SC18H23NO3c1118914(1012(11)2)13(3)1917(20)15645716(15)18(21)22h45810131516H67H213H3(H1920)(H2122)
MFCD06175209
ZINC000013320348
ZINC000239159586
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