Vitas-M small molecule compound
3-{[(2,6-dichlorophenyl)carbonyl]amino}-3-(3-nitrophenyl)propanoic acid
Catalog ID
STK680181
SMILES OC(=O)CC(c1cccc(c1)[N+](=O)[O-])NC(=O)c1c(Cl)cccc1Cl
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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 C16H12Cl2N2O5 MW 383.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12Cl2N2O5/c17-11-5-2-6-12(18)15(11)16(23)19-13(8-14(21)22)9-3-1-4-10(7-9)20(24)25/h1-7,13H,8H2,(H,19,23)(H,21,22)InChIKey
IRRIXZZRBRMQMX-UHFFFAOYSA-NSynonyms
(3R)3((26DICHLOROBENZOYL)AMINO)3(3NITROPHENYL)PROPANOICACID
3(((26dichlorophenyl)carbonyl)amino)3(3nitrophenyl)propanoicacid
3((26DICHLOROBENZOYL)AMINO)3(3NITROPHENYL)PROPANOICACID
C1=CC(=CC(=C1)(N+)(=O)(O))C(CC(=O)O)NC(=O)C2=C(C=CC=C2Cl)Cl
InChI=1SC16H12Cl2N2O5c171152612(18)15(11)16(23)1913(814(21)22)931410(79)20(24)25h1713H8H2(H1923)(H2122)
MFCD03766820
OC(=O)CC(c1cccc(c1)(N+)(=O)(O))NC(=O)c1c(Cl)cccc1Cl
ZINC000004602033
ZINC000004602036
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