Vitas-M small molecule compound

4-[(Z)-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]benzoic acid

Catalog ID
STK326189
SMILES Brc1ccc2c(c1)/C(=C/c1ccc(cc1)C(=O)O)/C(=O)N2

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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 C16H10BrNO3 MW 344.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10BrNO3/c17-11-5-6-14-12(8-11)13(15(19)18-14)7-9-1-3-10(4-2-9)16(20)21/h1-8H,(H,18,19)(H,20,21)/b13-7-
InChIKey
FJJOERDWQBCVAB-QPEQYQDCSA-N
Synonyms

4((Z)(5bromo2oxo12dihydro3Hindol3ylidene)methyl)benzoicacid
4((Z)(5BROMO2OXO1HINDOL3YLIDENE)METHYL)BENZOICACID
Brc1ccc2c(c1)C(=Cc1ccc(cc1)C(=O)O)C(=O)N2
C1=CC(=CC=C1C=C2C3=C(C=CC(=C3)Br)NC2=O)C(=O)O
InChI=1SC16H10BrNO3c1711561412(811)13(15(19)1814)791310(429)16(20)21h18H(H1819)(H2021)b137
MFCD03080460
ZINC000015016131
ZINC15016131

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.