Vitas-M small molecule compound
3-{[(3,5-dimethoxyphenyl)carbonyl]amino}-3-(3-nitrophenyl)propanoic acid
Catalog ID
STK681117
SMILES COc1cc(OC)cc(c1)C(=O)NC(c1cccc(c1)[N+](=O)[O-])CC(=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 C18H18N2O7 MW 374.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O7/c1-26-14-7-12(8-15(9-14)27-2)18(23)19-16(10-17(21)22)11-4-3-5-13(6-11)20(24)25/h3-9,16H,10H2,1-2H3,(H,19,23)(H,21,22)InChIKey
DHIIWFGOKXLNRI-UHFFFAOYSA-NSynonyms
(3S)3((35DIMETHOXYBENZOYL)AMINO)3(3NITROPHENYL)PROPANOICACID3(((35dimethoxyphenyl)carbonyl)amino)3(3nitrophenyl)propanoicacid
3((35DIMETHOXYBENZOYL)AMINO)3(3NITROPHENYL)PROPANOICACID
3((35DIMETHOXYPHENYL)CARBONYLAMINO)3(3NITROPHENYL)PROPANOICACID
COC1=CC(=CC(=C1)C(=O)NC(CC(=O)O)C2=CC(=CC=C2)(N+)(=O)(O))OC
COc1cc(OC)cc(c1)C(=O)NC(c1cccc(c1)(N+)(=O)(O))CC(=O)O
Registry IDs
MFCD03768223ZINC000004581226
ZINC000004581228
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