Vitas-M small molecule compound

2-[1-(3-nitrophenyl)-1H-pyrrol-2-yl]-4,4-diphenyl-1,4-dihydro-2H-3,1-benzoxazine

Catalog ID
STK689490
SMILES [O-][N+](=O)c1cccc(c1)n1cccc1C1Nc2ccccc2C(O1)(c1ccccc1)c1ccccc1

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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 C30H23N3O3 MW 473.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23N3O3/c34-33(35)25-16-9-15-24(21-25)32-20-10-19-28(32)29-31-27-18-8-7-17-26(27)30(36-29,22-11-3-1-4-12-22)23-13-5-2-6-14-23/h1-21,29,31H
InChIKey
FDFXAPVVZKWBLR-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1cccc(c1)n1cccc1C1Nc2ccccc2C(O1)(c1ccccc1)c1ccccc1
2(1(3nitrophenyl)1Hpyrrol2yl)44diphenyl14dihydro2H31benzoxazine
2(1(3nitrophenyl)pyrrol2yl)44diphenyl12dihydro31benzoxazine
C1=CC=C(C=C1)C2(C3=CC=CC=C3NC(O2)C4=CC=CN4C5=CC(=CC=C5)(N+)(=O)(O))C6=CC=CC=C6
InChI=1SC30H23N3O3c3433(35)251691524(2125)3220101928(32)29312718871726(27)30(362922113141222)23135261423h1212931H
MFCD08142990
ZINC000012376062
ZINC000012376063

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Available files

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