Vitas-M small molecule compound

3-{[(3-bromophenyl)carbonyl]amino}-3-(3-nitrophenyl)propanoic acid

Catalog ID
STK770068
SMILES OC(=O)CC(c1cccc(c1)[N+](=O)[O-])NC(=O)c1cccc(c1)Br

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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 C16H13BrN2O5 MW 393.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13BrN2O5/c17-12-5-1-4-11(7-12)16(22)18-14(9-15(20)21)10-3-2-6-13(8-10)19(23)24/h1-8,14H,9H2,(H,18,22)(H,20,21)
InChIKey
OXJWTIJAWAGOQY-UHFFFAOYSA-N
Synonyms
640238-65-9
(3S)3((3BROMOBENZOYL)AMINO)3(3NITROPHENYL)PROPANOICACID
3(((3bromophenyl)carbonyl)amino)3(3nitrophenyl)propanoicacid
3((3BROMOBENZOYL)AMINO)3(3NITROPHENYL)PROPANOICACID
3((3BROMOPHENYL)CARBONYLAMINO)3(3NITROPHENYL)PROPANOICACID
3(3bromobenzamido)3(3nitrophenyl)propanoicacid
640238659
C1=CC(=CC(=C1)(N+)(=O)(O))C(CC(=O)O)NC(=O)C2=CC(=CC=C2)Br
InChI=1SC16H13BrN2O5c171251411(712)16(22)1814(915(20)21)1032613(810)19(23)24h1814H9H2(H1822)(H2021)
MFCD02278364
OC(=O)CC(c1cccc(c1)(N+)(=O)(O))NC(=O)c1cccc(c1)Br
ZINC000004580526
ZINC000004580527

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Available files

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