Vitas-M small molecule compound

5-(4-nitrophenyl)-3-[4-(octyloxy)phenyl]-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione

Catalog ID
STK641667
SMILES CCCCCCCCOc1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-])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 C31H33N3O6 MW 543.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33N3O6/c1-2-3-4-5-6-10-21-39-26-19-13-22(14-20-26)28-27-29(40-33(28)24-11-8-7-9-12-24)31(36)32(30(27)35)23-15-17-25(18-16-23)34(37)38/h7-9,11-20,27-29H,2-6,10,21H2,1H3
InChIKey
HNYGVFNSMCPWFM-UHFFFAOYSA-N
Synonyms
1023209-57-5
1023209575
5(4nitrophenyl)3(4(octyloxy)phenyl)2phenyldihydro2Hpyrrolo(34d)(12)oxazole46(3H5H)dione
5(4nitrophenyl)3(4(octyloxy)phenyl)2phenyldihydro2Hpyrrolo(34d)isoxazole46(5H6aH)dione
5(4NITROPHENYL)3(4OCTOXYPHENYL)2PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOLE46DIONE
CCCCCCCCOC1=CC=C(C=C1)C2C3C(C(=O)N(C3=O)C4=CC=C(C=C4)(N+)(=O)(O))ON2C5=CC=CC=C5
CCCCCCCCOc1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)(N+)(=O)(O))c1ccccc1
InChI=1SC31H33N3O6c12345610213926191322(142026)282729(4033(28)24118791224)31(36)32(30(27)35)23151725(181623)34(37)38h7911202729H261021H21H3
MFCD03683428
ZINC000097952155
ZINC000227163580

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Available files

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