Vitas-M small molecule compound
3-(4-chlorophenyl)-3-{[(3-nitrophenyl)carbonyl]amino}propanoic acid
Catalog ID
STK682764
SMILES OC(=O)CC(c1ccc(cc1)Cl)NC(=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 C16H13ClN2O5 MW 348.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClN2O5/c17-12-6-4-10(5-7-12)14(9-15(20)21)18-16(22)11-2-1-3-13(8-11)19(23)24/h1-8,14H,9H2,(H,18,22)(H,20,21)InChIKey
MCMWWGMJMQAINJ-UHFFFAOYSA-NSynonyms
3(4chlorophenyl)3(((3nitrophenyl)carbonyl)amino)propanoicacid
3(4CHLOROPHENYL)3((3NITROBENZOYL)AMINO)PROPANOICACID
3(4CHLOROPHENYL)3((3NITROPHENYL)CARBONYLAMINO)PROPANOICACID
C1=CC(=CC(=C1)(N+)(=O)(O))C(=O)NC(CC(=O)O)C2=CC=C(C=C2)Cl
InChI=1SC16H13ClN2O5c17126410(5712)14(915(20)21)1816(22)1121313(811)19(23)24h1814H9H2(H1822)(H2021)
MFCD04060735
OC(=O)CC(c1ccc(cc1)Cl)NC(=O)c1cccc(c1)(N+)(=O)(O)
ZINC000004653729
ZINC000004653731
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