Vitas-M small molecule compound

methyl (2E)-2-{2-[(4-methoxyphenyl)carbonyl]hydrazinylidene}-5,5-dimethyl-4-oxohexanoate

Catalog ID
STK396768
SMILES COC(=O)/C(=N/NC(=O)c1ccc(cc1)OC)/CC(=O)C(C)(C)C

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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 C17H22N2O5 MW 334.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O5/c1-17(2,3)14(20)10-13(16(22)24-5)18-19-15(21)11-6-8-12(23-4)9-7-11/h6-9H,10H2,1-5H3,(H,19,21)/b18-13+
InChIKey
OXFHNMPKTPCISL-QGOAFFKASA-N
Synonyms

CC(C)(C)C(=O)CC(=NNC(=O)C1=CC=C(C=C1)OC)C(=O)OC
COC(=O)C(=NNC(=O)c1ccc(cc1)OC)CC(=O)C(C)(C)C
InChI=1SC17H22N2O5c117(23)14(20)1013(16(22)245)181915(21)116812(234)9711h69H10H215H3(H1921)b1813+
METHYL(2E)2((4METHOXYBENZOYL)HYDRAZINYLIDENE)55DIMETHYL4OXOHEXANOATE
METHYL(2E)2(2((4METHOXYPHENYL)CARBONYL)HYDRAZINYLIDENE)55DIMETHYL4OXOHEXANOATE
METHYL(2E)2(33DIMETHYL2OXOBUTYL)3((4METHOXYPHENYL)CARBONYLAMINO)3AZAPROP2ENOATE
MFCD00510722
ZINC000016102402
ZINC6615010

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Available files

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