Vitas-M small molecule compound

4-butoxy-N-(spiro[1,3-benzodioxole-2,1'-cyclohexan]-5-yl)benzamide

Catalog ID
STK149494
SMILES CCCCOc1ccc(cc1)C(=O)Nc1ccc2c(c1)OC1(O2)CCCCC1

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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 C23H27NO4 MW 381.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27NO4/c1-2-3-15-26-19-10-7-17(8-11-19)22(25)24-18-9-12-20-21(16-18)28-23(27-20)13-5-4-6-14-23/h7-12,16H,2-6,13-15H2,1H3,(H,24,25)
InChIKey
NLFSFGHJWYWHOJ-UHFFFAOYSA-N
Synonyms

4BUTOXYN(SPIRO(13BENZODIOXOLE21CYCLOHEXAN)5YL)BENZAMIDE
4BUTOXYNSPIRO(13BENZODIOXOLE21CYCLOHEXANE)5YLBENZAMIDE
CCCCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)OC4(O3)CCCCC4
InChI=1SC23H27NO4c12315261910717(81119)22(25)24189122021(1618)2823(2720)135461423h71216H261315H21H3(H2425)
MFCD02018953
ZINC000002997976
ZINC02997976
ZINC2997976

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Available files

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