Vitas-M small molecule compound

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

Catalog ID
STK996036
SMILES CCCC(=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 C22H29NO3 MW 355.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29NO3/c1-3-10-18(24)23-20-17-12-7-6-11-16(17)15-22(13-8-5-9-14-22)19(20)21(25)26-4-2/h6-7,11-12H,3-5,8-10,13-15H2,1-2H3,(H,23,24)
InChIKey
IEIZRFGWYHXZMU-UHFFFAOYSA-N
Synonyms
300804-05-1
300804051
CCCC(=O)NC1=C(C2(CCCCC2)CC3=CC=CC=C31)C(=O)OCC
ETHYL1(BUTANOYLAMINO)SPIRO(4HNAPHTHALENE31CYCLOHEXANE)2CARBOXYLATE
ethyl4(butanoylamino)1Hspiro(cyclohexane12naphthalene)3carboxylate
ETHYL4BUTANAMIDO1HSPIRO(CYCLOHEXANE12NAPHTHALENE)3CARBOXYLATE
ethyl4butyramido1Hspiro(cyclohexane12naphthalene)3carboxylate
InChI=1SC22H29NO3c131018(24)23201712761116(17)1522(138591422)19(20)21(25)2642h671112H358101315H212H3(H2324)
MFCD00371156
ZINC000000866552
ZINC00866552
ZINC866552

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Available files

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