Vitas-M small molecule compound

2-benzyl-6,7-dimethyl-1-(4-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione

Catalog ID
STK820340
SMILES O=C1N(Cc2ccccc2)C(c2c1oc1cc(C)c(cc1c2=O)C)c1ccc(cc1)[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 C26H20N2O5 MW 440.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20N2O5/c1-15-12-20-21(13-16(15)2)33-25-22(24(20)29)23(18-8-10-19(11-9-18)28(31)32)27(26(25)30)14-17-6-4-3-5-7-17/h3-13,23H,14H2,1-2H3
InChIKey
GLBMQUKFCVKSGV-UHFFFAOYSA-N
Synonyms

(1S)2BENZYL67DIMETHYL1(4NITROPHENYL)12DIHYDROCHROMENO(23C)PYRROLE39DIONE
2benzyl67dimethyl1(4nitrophenyl)12dihydrochromeno(23c)pyrrole39dione
2BENZYL67DIMETHYL1(4NITROPHENYL)1HCHROMENO(23C)PYRROLE39DIONE
CC1=C(C=C2C(=C1)C(=O)C3=C(O2)C(=O)N(C3C4=CC=C(C=C4)(N+)(=O)(O))CC5=CC=CC=C5)C
InChI=1SC26H20N2O5c115122021(1316(15)2)332522(24(20)29)23(1881019(11918)28(31)32)27(26(25)30)14176435717h31323H14H212H3
MFCD05992148
O=C1N(Cc2ccccc2)C(c2c1oc1cc(C)c(cc1c2=O)C)c1ccc(cc1)(N+)(=O)(O)
ZINC000002859616
ZINC000002859617

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.