Vitas-M small molecule compound

6-nitro-2-[4-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]-1H-benzo[de]isoquinoline-1,3(2H)-dione

Catalog ID
STK371534
SMILES [O-][N+](=O)c1ccc2c3c1cccc3c(=O)n(c2=O)c1ccc(cc1)c1nc2ccccc2c(=O)o1

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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 C26H13N3O6 MW 463.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H13N3O6/c30-24-18-6-3-5-17-21(29(33)34)13-12-19(22(17)18)25(31)28(24)15-10-8-14(9-11-15)23-27-20-7-2-1-4-16(20)26(32)35-23/h1-13H
InChIKey
QEMGIUCIRMYOMI-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1ccc2c3c1cccc3c(=O)n(c2=O)c1ccc(cc1)c1nc2ccccc2c(=O)o1
6NITRO2(4(4OXO31BENZOXAZIN2YL)PHENYL)BENZO(DE)ISOQUINOLINE13DIONE
6nitro2(4(4oxo4H31benzoxazin2yl)phenyl)1Hbenzo(de)isoquinoline13(2H)dione
C1=CC=C2C(=C1)C(=O)OC(=N2)C3=CC=C(C=C3)N4C(=O)C5=C6C(=C(C=C5)(N+)(=O)(O))C=CC=C6C4=O
InChI=1SC26H13N3O6c3024186351721(29(33)34)131219(22(17)18)25(31)28(24)1510814(91115)232720721416(20)26(32)3523h113H
MFCD00316852
ZINC000000819809
ZINC00819809
ZINC819809

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Available files

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