Vitas-M small molecule compound
2-oxo-2-phenylethyl 1-[(4-methoxy-3-nitrophenyl)sulfonyl]piperidine-4-carboxylate
Catalog ID
STK807343
SMILES COc1ccc(cc1[N+](=O)[O-])S(=O)(=O)N1CCC(CC1)C(=O)OCC(=O)c1ccccc1
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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 C21H22N2O8S MW 462.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O8S/c1-30-20-8-7-17(13-18(20)23(26)27)32(28,29)22-11-9-16(10-12-22)21(25)31-14-19(24)15-5-3-2-4-6-15/h2-8,13,16H,9-12,14H2,1H3InChIKey
GVALBUOYYOAOEH-UHFFFAOYSA-NSynonyms
2oxo2phenylethyl1((4methoxy3nitrophenyl)sulfonyl)piperidine4carboxylate
COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCC(=O)C3=CC=CC=C3)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))S(=O)(=O)N1CCC(CC1)C(=O)OCC(=O)c1ccccc1
InChI=1SC21H22N2O8Sc130208717(1318(20)23(26)27)32(2829)2211916(101222)21(25)311419(24)155324615h281316H91214H21H3
MFCD04442819
PHENACYL1(4METHOXY3NITROPHENYL)SULFONYLPIPERIDINE4CARBOXYLATE
ZINC000008683993
ZINC08683993
ZINC8683993
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