Vitas-M small molecule compound

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

Catalog ID
STK053197
SMILES CCOC(=O)c1cccc(c1)NC(=O)/C=C/c1ccc(cc1)[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 C18H16N2O5 MW 340.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O5/c1-2-25-18(22)14-4-3-5-15(12-14)19-17(21)11-8-13-6-9-16(10-7-13)20(23)24/h3-12H,2H2,1H3,(H,19,21)/b11-8+
InChIKey
DVPBEOKGNLCTEH-DHZHZOJOSA-N
Synonyms
1164464-59-8
1164464598
CCOC(=O)C1=CC(=CC=C1)NC(=O)C=CC2=CC=C(C=C2)(N+)(=O)(O)
CCOC(=O)c1cccc(c1)NC(=O)C=Cc1ccc(cc1)(N+)(=O)(O)
ETHYL3(((2E)3(4NITROPHENYL)PROP2ENOYL)AMINO)BENZOATE
ETHYL3(((E)3(4NITROPHENYL)PROP2ENOYL)AMINO)BENZOATE
ETHYL3((2E)3(4NITROPHENYL)PROP2ENOYLAMINO)BENZOATE
ETHYL3((3(4NITROPHENYL)ACRYLOYL)AMINO)BENZOATE
InChI=1SC18H16N2O5c122518(22)1443515(1214)1917(21)118136916(10713)20(23)24h312H2H21H3(H1921)b118+
MFCD03638205
STK053197
ZINC000000465128
ZINC00465128
ZINC465128

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Available files

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