Vitas-M small molecule compound

3-[(4-methoxybenzyl)amino]-2-methylbenzoic acid

Catalog ID
STK511741
SMILES COc1ccc(cc1)CNc1cccc(c1C)C(=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 C16H17NO3 MW 271.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17NO3/c1-11-14(16(18)19)4-3-5-15(11)17-10-12-6-8-13(20-2)9-7-12/h3-9,17H,10H2,1-2H3,(H,18,19)
InChIKey
QPCRUDWHQXGQBG-UHFFFAOYSA-N
Synonyms
886632-50-4
3((4methoxybenzyl)amino)2methylbenzoicacid
3((4methoxyphenyl)methylamino)2methylbenzoicacid
886632504
CC1=C(C=CC=C1NCC2=CC=C(C=C2)OC)C(=O)O
InChI=1SC16H17NO3c11114(16(18)19)43515(11)1710126813(202)9712h3917H10H212H3(H1819)
MFCD07611954
ZINC000016578310
ZINC16578310

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Available files

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