Vitas-M small molecule compound

ethyl 4-{[(3aS,6R)-1-oxo-2-phenyl-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindol-7-yl]carbonyl}piperazine-1-carboxylate

Catalog ID
STK601563
SMILES CCOC(=O)N1CCN(CC1)C(=O)C1[C@@H]2C=C[C@@]3(C1C(=O)N(C3)c1ccccc1)O2

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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 C22H25N3O5 MW 411.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O5/c1-2-29-21(28)24-12-10-23(11-13-24)19(26)17-16-8-9-22(30-16)14-25(20(27)18(17)22)15-6-4-3-5-7-15/h3-9,16-18H,2,10-14H2,1H3/t16-,17?,18?,22-/m1/s1
InChIKey
SFXVERHUKIUIFY-UXHQMKPLSA-N
Synonyms
1212485-04-5
1212485045
CCOC(=O)N1CCN(CC1)C(=O)(C@@H)1(C@H)2C=C(C@@)3((C@H)1C(=O)N(C3)c1ccccc1)O2
CCOC(=O)N1CCN(CC1)C(=O)C1(C@@H)2C=C(C@@)3(C1C(=O)N(C3)c1ccccc1)O2
ethyl4(((3aS6R)1oxo2phenyl123677ahexahydro3a6epoxyisoindol7yl)carbonyl)piperazine1carboxylate
ethyl4((3aS6R)1oxo2phenyl123677ahexahydro3a6epoxyisoindole7carbonyl)piperazine1carboxylate
MFCD18246147
ZINC000009418819
ZINC000009418822

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Available files

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