Vitas-M small molecule compound

9,11-dinitrobenzo[b]naphtho[1,2-f]oxepine

Catalog ID
STK760097
SMILES [O-][N+](=O)c1cc(cc2c1C=Cc1c(O2)ccc2c1cccc2)[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 C18H10N2O5 MW 334.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H10N2O5/c21-19(22)12-9-16(20(23)24)15-7-6-14-13-4-2-1-3-11(13)5-8-17(14)25-18(15)10-12/h1-10H
InChIKey
XIHJOBWXVAGSCV-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1cc(cc2c1C=Cc1c(O2)ccc2c1cccc2)(N+)(=O)(O)
911dinitrobenzo(b)naphtho(12f)oxepine
911DINITROBENZO(F)NAPHTHO(21B)OXEPIN
911DINITRONAPHTHO(21B)(1)BENZOXEPINE
C1=CC=C2C(=C1)C=CC3=C2C=CC4=C(C=C(C=C4O3)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC18H10N2O5c2119(22)12916(20(23)24)15761413421311(13)5817(14)2518(15)1012h110H
MFCD01571844
ZINC000002186328
ZINC02186328
ZINC2186328

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Available files

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