Vitas-M small molecule compound

ethyl 2-(morpholin-4-yl)-5-{[(2E)-3-(3-nitrophenyl)prop-2-enoyl]amino}benzoate

Catalog ID
STK188764
SMILES CCOC(=O)c1cc(ccc1N1CCOCC1)NC(=O)/C=C/c1cccc(c1)[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 C22H23N3O6 MW 425.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O6/c1-2-31-22(27)19-15-17(7-8-20(19)24-10-12-30-13-11-24)23-21(26)9-6-16-4-3-5-18(14-16)25(28)29/h3-9,14-15H,2,10-13H2,1H3,(H,23,26)/b9-6+
InChIKey
UMAPXLICDCIYQK-RMKNXTFCSA-N
Synonyms

CCOC(=O)C1=C(C=CC(=C1)NC(=O)C=CC2=CC(=CC=C2)(N+)(=O)(O))N3CCOCC3
CCOC(=O)c1cc(ccc1N1CCOCC1)NC(=O)C=Cc1cccc(c1)(N+)(=O)(O)
ETHYL2(MORPHOLIN4YL)5(((2E)3(3NITROPHENYL)PROP2ENOYL)AMINO)BENZOATE
ETHYL2MORPHOLIN4YL5(((E)3(3NITROPHENYL)PROP2ENOYL)AMINO)BENZOATE
InChI=1SC22H23N3O6c123122(27)191517(7820(19)24101230131124)2321(26)961643518(1416)25(28)29h391415H21013H21H3(H2326)b96+
MFCD06664862
ZINC000009907803
ZINC09907803
ZINC9907803

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Available files

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