Vitas-M small molecule compound
3-(3,4-dimethoxyphenyl)-3-{[(3-nitrophenyl)carbonyl]amino}propanoic acid
Catalog ID
STK682182
SMILES COc1cc(ccc1OC)C(NC(=O)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/c1-26-15-7-6-11(9-16(15)27-2)14(10-17(21)22)19-18(23)12-4-3-5-13(8-12)20(24)25/h3-9,14H,10H2,1-2H3,(H,19,23)(H,21,22)InChIKey
RSCCTXHEJWOOSE-UHFFFAOYSA-NSynonyms
(3R)3(34DIMETHOXYPHENYL)3((3NITROBENZOYL)AMINO)PROPANOICACID
3(34dimethoxyphenyl)3(((3nitrophenyl)carbonyl)amino)propanoicacid
3(34DIMETHOXYPHENYL)3((3NITROBENZOYL)AMINO)PROPANOICACID
COC1=C(C=C(C=C1)C(CC(=O)O)NC(=O)C2=CC(=CC=C2)(N+)(=O)(O))OC
COc1cc(ccc1OC)C(NC(=O)c1cccc(c1)(N+)(=O)(O))CC(=O)O
InChI=1SC18H18N2O7c126157611(916(15)272)14(1017(21)22)1918(23)1243513(812)20(24)25h3914H10H212H3(H1923)(H2122)
MFCD03821659
ZINC000004601110
ZINC000004601112
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