Vitas-M small molecule compound
3-{[4-(2-methoxyphenyl)piperazin-1-yl]carbonyl}bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STK375496
SMILES COc1ccccc1N1CCN(CC1)C(=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 C20H24N2O4 MW 356.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O4/c1-26-16-5-3-2-4-15(16)21-8-10-22(11-9-21)19(23)17-13-6-7-14(12-13)18(17)20(24)25/h2-7,13-14,17-18H,8-12H2,1H3,(H,24,25)InChIKey
XETXTEAPMQOLHX-UHFFFAOYSA-NSynonyms
470472-72-12(4(2METHOXYPHENYL)PIPERAZINE1CARBONYL)BICYCLO(221)HEPT5ENE3CARBOXYLICACID
3((4(2METHOXYPHENYL)1PIPERAZINYL)CARBONYL)BICYCLO(221)HEPT5ENE2CARBOXYLICACID
3((4(2methoxyphenyl)piperazin1yl)carbonyl)bicyclo(221)hept5ene2carboxylicacid
470472721
COC1=CC=CC=C1N2CCN(CC2)C(=O)C3C4CC(C3C(=O)O)C=C4
InChI=1SC20H24N2O4c12616532415(16)2181022(11921)19(23)17136714(1213)18(17)20(24)25h2713141718H812H21H3(H2425)
MFCD01342509
ZINC000100897453
ZINC000239433088
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