Vitas-M small molecule compound

6-methyl-10-nitro-13,13-diphenyl-11bH,13H-[1,3]benzoxazino[3,4-a][3,1]benzoxazine

Catalog ID
STK752117
SMILES CC1Oc2ccc(cc2C2N1c1ccccc1C(O2)(c1ccccc1)c1ccccc1)[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 C28H22N2O4 MW 450.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N2O4/c1-19-29-25-15-9-8-14-24(25)28(20-10-4-2-5-11-20,21-12-6-3-7-13-21)34-27(29)23-18-22(30(31)32)16-17-26(23)33-19/h2-19,27H,1H3
InChIKey
CHMLMVVLVGKIDN-UHFFFAOYSA-N
Synonyms

6methyl10nitro1313diphenyl11bH13H(13)benzoxazino(34a)(31)benzoxazine
6methyl10nitro1313diphenyl611bdihydro(13)benzoxazino(34a)(31)benzoxazine
CC1N2C(C3=C(O1)C=CC(=C3)(N+)(=O)(O))OC(C4=CC=CC=C42)(C5=CC=CC=C5)C6=CC=CC=C6
CC1Oc2ccc(cc2C2N1c1ccccc1C(O2)(c1ccccc1)c1ccccc1)(N+)(=O)(O)
InChI=1SC28H22N2O4c119292515981424(25)28(2010425112021126371321)3427(29)231822(30(31)32)161726(23)3319h21927H1H3
MFCD00819420
ZINC000015134561
ZINC000015134566

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Available files

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