Vitas-M small molecule compound
2-(4-nitrophenyl)-2-oxoethyl 4-(16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)benzoate (non-preferred name)
Catalog ID
STK268476
SMILES O=C1N(c2ccc(cc2)C(=O)OCC(=O)c2ccc(cc2)[N+](=O)[O-])C(=O)C2C1C1c3ccccc3C2c2c1cccc2
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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 C33H22N2O7 MW 558.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H22N2O7/c36-26(18-9-15-21(16-10-18)35(40)41)17-42-33(39)19-11-13-20(14-12-19)34-31(37)29-27-22-5-1-2-6-23(22)28(30(29)32(34)38)25-8-4-3-7-24(25)27/h1-16,27-30H,17H2InChIKey
CCJOLOSYOLPDCX-UHFFFAOYSA-NSynonyms
353524-49-92(4nitrophenyl)2oxoethyl4(1214dioxo11121415tetrahydro9H910(34)epipyrroloanthracen13(10H)yl)benzoate
2(4nitrophenyl)2oxoethyl4(1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)benzoate(nonpreferredname)
353524499
C1=CC=C2C3C4C(C(C2=C1)C5=CC=CC=C35)C(=O)N(C4=O)C6=CC=C(C=C6)C(=O)OCC(=O)C7=CC=C(C=C7)(N+)(=O)(O)
InChI=1SC33H22N2O7c3626(1891521(161018)35(40)41)174233(39)19111320(141219)3431(37)292722512623(22)28(30(29)32(34)38)25843724(25)27h1162730H17H2
MFCD01156512
O=C1N(c2ccc(cc2)C(=O)OCC(=O)c2ccc(cc2)(N+)(=O)(O))C(=O)C2C1C1c3ccccc3C2c2c1cccc2
ZINC000000832725
ZINC000000832728
Check stock
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Check stock on Vitas-MAvailable files
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