Vitas-M small molecule compound

methyl 3-[(cyclohexylamino)methyl]-4-methoxybenzoate

Catalog ID
STK350423
SMILES COc1ccc(cc1CNC1CCCCC1)C(=O)OC

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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 C16H23NO3 MW 277.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23NO3/c1-19-15-9-8-12(16(18)20-2)10-13(15)11-17-14-6-4-3-5-7-14/h8-10,14,17H,3-7,11H2,1-2H3
InChIKey
RASKANXPDRQCSG-UHFFFAOYSA-N
Synonyms
886504-38-7
3CYCLOHEXYLAMINOMETHYL4METHOXYBENZOICACIDMET
3CYCLOHEXYLAMINOMETHYL4METHOXYBENZOICACIDMETHYLESTER
886504387
COC1=C(C=C(C=C1)C(=O)OC)CNC2CCCCC2
InChI=1SC16H23NO3c119159812(16(18)202)1013(15)1117146435714h8101417H3711H212H3
methyl3((cyclohexylamino)methyl)4methoxybenzoate
MFCD06739315
ZINC000004298649
ZINC4298649

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Available files

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