Vitas-M small molecule compound
ethyl 1-[N-(2-methoxy-5-nitrophenyl)-N-(methylsulfonyl)glycyl]piperidine-4-carboxylate
Catalog ID
STL072145
SMILES CCOC(=O)C1CCN(CC1)C(=O)CN(S(=O)(=O)C)c1cc(ccc1OC)[N+](=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 C18H25N3O8S MW 443.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25N3O8S/c1-4-29-18(23)13-7-9-19(10-8-13)17(22)12-20(30(3,26)27)15-11-14(21(24)25)5-6-16(15)28-2/h5-6,11,13H,4,7-10,12H2,1-3H3InChIKey
XGWCTFQOCIONJC-UHFFFAOYSA-NSynonyms
CCOC(=O)C1CCN(CC1)C(=O)CN(C2=C(C=CC(=C2)(N+)(=O)(O))OC)S(=O)(=O)C
CCOC(=O)C1CCN(CC1)C(=O)CN(S(=O)(=O)C)c1cc(ccc1OC)(N+)(=O)(O)
ETHYL1(2(2METHOXYNMETHYLSULFONYL5NITROANILINO)ACETYL)PIPERIDINE4CARBOXYLATE
ethyl1(N(2methoxy5nitrophenyl)N(methylsulfonyl)glycyl)piperidine4carboxylate
InChI=1SC18H25N3O8Sc142918(23)137919(10813)17(22)1220(30(326)27)151114(21(24)25)5616(15)282h561113H471012H213H3
MFCD06629150
ZINC000013896739
ZINC13896739
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