Vitas-M small molecule compound
N-{7-[(4-methoxyphenyl)carbonyl]-2,3-dihydro-1,4-benzodioxin-6-yl}-3-nitrobenzamide
Catalog ID
STK227912
SMILES COc1ccc(cc1)C(=O)c1cc2OCCOc2cc1NC(=O)c1cccc(c1)[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 C23H18N2O7 MW 434.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N2O7/c1-30-17-7-5-14(6-8-17)22(26)18-12-20-21(32-10-9-31-20)13-19(18)24-23(27)15-3-2-4-16(11-15)25(28)29/h2-8,11-13H,9-10H2,1H3,(H,24,27)InChIKey
SQWGVEYVAUEDRS-UHFFFAOYSA-NSynonyms
COC1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2NC(=O)C4=CC(=CC=C4)(N+)(=O)(O))OCCO3
COc1ccc(cc1)C(=O)c1cc2OCCOc2cc1NC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC23H18N2O7c130177514(6817)22(26)18122021(321093120)1319(18)2423(27)1532416(1115)25(28)29h281113H910H21H3(H2427)
MFCD08336260
N(7((4methoxyphenyl)carbonyl)23dihydro14benzodioxin6yl)3nitrobenzamide
N(7(4METHOXYBENZOYL)23DIHYDRO14BENZODIOXIN6YL)3NITROBENZAMIDE
ZINC000009289077
ZINC09289077
ZINC9289077
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