Vitas-M small molecule compound

4-nitro-2,13-dihydronaphtho[1',2':6,7]oxepino[4,3,2-cd]indole

Catalog ID
STK780581
SMILES [O-][N+](=O)c1cc2Oc3ccc4c(c3Cc3c2c(c1)[nH]c3)cccc4

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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 C19H12N2O3 MW 316.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12N2O3/c22-21(23)13-8-16-19-12(10-20-16)7-15-14-4-2-1-3-11(14)5-6-17(15)24-18(19)9-13/h1-6,8-10,20H,7H2
InChIKey
YCKXJMYTDXBFOW-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1cc2Oc3ccc4c(c3Cc3c2c(c1)(nH)c3)cccc4
4nitro213dihydronaphtho(1267)oxepino(432cd)indole
C1C2=CNC3=CC(=CC(=C23)OC4=C1C5=CC=CC=C5C=C4)(N+)(=O)(O)
InChI=1SC19H12N2O3c2221(23)138161912(102016)71514421311(14)5617(15)2418(19)913h1681020H7H2
MFCD06013349
ZINC000001431749
ZINC01431749
ZINC1431749

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Available files

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