Vitas-M small molecule compound

methyl 2-{[(2E)-3-(2-methoxyphenyl)prop-2-enoyl]amino}benzoate

Catalog ID
STL118225
SMILES COC(=O)c1ccccc1NC(=O)/C=C/c1ccccc1OC

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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 C18H17NO4 MW 311.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO4/c1-22-16-10-6-3-7-13(16)11-12-17(20)19-15-9-5-4-8-14(15)18(21)23-2/h3-12H,1-2H3,(H,19,20)/b12-11+
InChIKey
AFTXNKBMSKXCFI-VAWYXSNFSA-N
Synonyms

COC(=O)c1ccccc1NC(=O)C=Cc1ccccc1OC
COC1=CC=CC=C1C=CC(=O)NC2=CC=CC=C2C(=O)OC
InChI=1SC18H17NO4c122161063713(16)111217(20)1915954814(15)18(21)232h312H12H3(H1920)b1211+
methyl2(((2E)3(2methoxyphenyl)prop2enoyl)amino)benzoate
METHYL2(((E)3(2METHOXYPHENYL)PROP2ENOYL)AMINO)BENZOATE
MFCD03254240
ZINC000000469034
ZINC00469034
ZINC469034

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Available files

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