Vitas-M small molecule compound

2-(3',3'-dimethyl-6-nitrospiro[chromene-2,2'-indol]-1'(3'H)-yl)ethyl 2-fluorobenzoate

Catalog ID
STK524509
SMILES O=C(c1ccccc1F)OCCN1c2ccccc2C(C21C=Cc1c(O2)ccc(c1)[N+](=O)[O-])(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 C27H23FN2O5 MW 474.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23FN2O5/c1-26(2)21-8-4-6-10-23(21)29(15-16-34-25(31)20-7-3-5-9-22(20)28)27(26)14-13-18-17-19(30(32)33)11-12-24(18)35-27/h3-14,17H,15-16H2,1-2H3
InChIKey
GWOPHLSZWRCRQD-UHFFFAOYSA-N
Synonyms
321555-22-0
2(33DIMETHYL6NITRO23DIHYDROSPIRO(2HCHROMENE22(1H)INDOLE)1YL)ETHYL2FLUOROBENZOATE
2(33dimethyl6nitrospiro(chromene22indol)1(3H)yl)ethyl2fluorobenzoate
2(33DIMETHYL6NITROSPIRO(CHROMENE22INDOLE)1YL)ETHYL2FLUOROBENZOATE
2(33dimethyl6nitrospiro(chromene22indolin)1yl)ethyl2fluorobenzoate
321555220
CC1(C2=CC=CC=C2N(C13C=CC4=C(O3)C=CC(=C4)(N+)(=O)(O))CCOC(=O)C5=CC=CC=C5F)C
InChI=1SC27H23FN2O5c126(2)218461023(21)29(15163425(31)20735922(20)28)27(26)1413181719(30(32)33)111224(18)3527h31417H1516H212H3
MFCD00701123
O=C(c1ccccc1F)OCCN1c2ccccc2C(C21C=Cc1c(O2)ccc(c1)(N+)(=O)(O))(C)C
ZINC000002055040
ZINC000002055041

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Available files

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