Vitas-M small molecule compound

5-(4-ethoxyphenyl)-3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione

Catalog ID
STL051305
SMILES CCOc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1cccc(c1)[N+](=O)[O-])c1ccc(c(c1)OC)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 C26H23N3O8 MW 505.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N3O8/c1-3-36-19-10-8-16(9-11-19)27-25(31)22-23(15-7-12-20(30)21(13-15)35-2)28(37-24(22)26(27)32)17-5-4-6-18(14-17)29(33)34/h4-14,22-24,30H,3H2,1-2H3
InChIKey
PHDVXTXVVOLFOG-UHFFFAOYSA-N
Synonyms
1022419-74-4
1022419744
5(4ETHOXYPHENYL)3(4HYDROXY3METHOXYPHENYL)2(3NITROPHENYL)3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOLE46DIONE
5(4ethoxyphenyl)3(4hydroxy3methoxyphenyl)2(3nitrophenyl)dihydro2Hpyrrolo(34d)(12)oxazole46(3H5H)dione
5(4ETHOXYPHENYL)3(4HYDROXY3METHOXYPHENYL)2(3NITROPHENYL)DIHYDRO2HPYRROLO(34D)ISOXAZOLE46(3H5H)DIONE
5(4ethoxyphenyl)3(4hydroxy3methoxyphenyl)2(3nitrophenyl)dihydro2Hpyrrolo(34d)isoxazole46(5H6aH)dione
CCOC1=CC=C(C=C1)N2C(=O)C3C(N(OC3C2=O)C4=CC(=CC=C4)(N+)(=O)(O))C5=CC(=C(C=C5)O)OC
CCOc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1cccc(c1)(N+)(=O)(O))c1ccc(c(c1)OC)O
InChI=1SC26H23N3O8c13361910816(91119)2725(31)2223(1571220(30)21(1315)352)28(3724(22)26(27)32)1754618(1417)29(33)34h414222430H3H212H3
MFCD04184295
ZINC000013777427
ZINC000245246832

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Available files

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