Vitas-M small molecule compound

methyl 1-methyl-6-nitro-2-oxo-1-(phenylcarbonyl)-1,7b-dihydrocyclopropa[c]chromene-1a(2H)-carboxylate

Catalog ID
STL048042
SMILES COC(=O)C12C(=O)Oc3c(C1C2(C)C(=O)c1ccccc1)cc(cc3)[N+](=O)[O-]

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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 C20H15NO7 MW 381.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15NO7/c1-19(16(22)11-6-4-3-5-7-11)15-13-10-12(21(25)26)8-9-14(13)28-18(24)20(15,19)17(23)27-2/h3-10,15H,1-2H3
InChIKey
UKNKZORBGHIYAD-UHFFFAOYSA-N
Synonyms
1005163-74-5
1005163745
CC1(C2C1(C(=O)OC3=C2C=C(C=C3)(N+)(=O)(O))C(=O)OC)C(=O)C4=CC=CC=C4
COC(=O)C12C(=O)Oc3c(C1C2(C)C(=O)c1ccccc1)cc(cc3)(N+)(=O)(O)
InChI=1SC20H15NO7c119(16(22)116435711)15131012(21(25)26)8914(13)2818(24)20(1519)17(23)272h31015H12H3
methyl1benzoyl1methyl6nitro2oxo11a27btetrahydrocyclopropa(c)chromene1acarboxylate
METHYL1BENZOYL1METHYL6NITRO2OXO7BHCYCLOPROPA(C)CHROMENE1ACARBOXYLATE
methyl1methyl6nitro2oxo1(phenylcarbonyl)17bdihydrocyclopropa(c)chromene1a(2H)carboxylate
MFCD04183708
ZINC000001120568
ZINC000101107854

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Available files

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