Vitas-M small molecule compound

dimethyl 5-({[4-(morpholin-4-yl)-3-nitrophenyl]carbonyl}amino)benzene-1,3-dicarboxylate

Catalog ID
STK295109
SMILES COC(=O)c1cc(cc(c1)C(=O)OC)NC(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCOCC1

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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 C21H21N3O8 MW 443.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O8/c1-30-20(26)14-9-15(21(27)31-2)11-16(10-14)22-19(25)13-3-4-17(18(12-13)24(28)29)23-5-7-32-8-6-23/h3-4,9-12H,5-8H2,1-2H3,(H,22,25)
InChIKey
ZGWQCCJXQZVJGE-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)(N+)(=O)(O))C(=O)OC
COC(=O)c1cc(cc(c1)C(=O)OC)NC(=O)c1ccc(c(c1)(N+)(=O)(O))N1CCOCC1
dimethyl5(((4(morpholin4yl)3nitrophenyl)carbonyl)amino)benzene13dicarboxylate
DIMETHYL5((4MORPHOLIN4YL3NITROBENZOYL)AMINO)BENZENE13DICARBOXYLATE
InChI=1SC21H21N3O8c13020(26)14915(21(27)312)1116(1014)2219(25)133417(18(1213)24(28)29)2357328623h34912H58H212H3(H2225)
MFCD04680534
ZINC000013946355
ZINC13946355

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Available files

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