Vitas-M small molecule compound

ethyl 4'-(pentanoylamino)-1'H-spiro[cyclohexane-1,2'-naphthalene]-3'-carboxylate

Catalog ID
STK836045
SMILES CCCCC(=O)NC1=C(C(=O)OCC)C2(Cc3c1cccc3)CCCCC2

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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 C23H31NO3 MW 369.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31NO3/c1-3-5-13-19(25)24-21-18-12-8-7-11-17(18)16-23(14-9-6-10-15-23)20(21)22(26)27-4-2/h7-8,11-12H,3-6,9-10,13-16H2,1-2H3,(H,24,25)
InChIKey
WSFWPFGZJFODMD-UHFFFAOYSA-N
Synonyms

CCCCC(=O)NC1=C(C2(CCCCC2)CC3=CC=CC=C31)C(=O)OCC
ETHYL1(PENTANOYLAMINO)SPIRO(4HNAPHTHALENE31CYCLOHEXANE)2CARBOXYLATE
ethyl4(pentanoylamino)1Hspiro(cyclohexane12naphthalene)3carboxylate
ethyl4pentanamido1Hspiro(cyclohexane12naphthalene)3carboxylate
InChI=1SC23H31NO3c1351319(25)24211812871117(18)1623(1496101523)20(21)22(26)2742h781112H369101316H212H3(H2425)
MFCD02989123
ZINC000002237440
ZINC02237440
ZINC2237440

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Available files

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