Vitas-M small molecule compound

3-({2-[(3-ethoxyphenyl)carbonyl]hydrazinyl}carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid

Catalog ID
STK428797
SMILES CCOc1cccc(c1)C(=O)NNC(=O)C1C2C=CC(C1C(=O)O)C2

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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 C18H20N2O5 MW 344.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O5/c1-2-25-13-5-3-4-12(9-13)16(21)19-20-17(22)14-10-6-7-11(8-10)15(14)18(23)24/h3-7,9-11,14-15H,2,8H2,1H3,(H,19,21)(H,20,22)(H,23,24)
InChIKey
PELCXBGISVDAOO-UHFFFAOYSA-N
Synonyms

2(((3ETHOXYBENZOYL)AMINO)CARBAMOYL)BICYCLO(221)HEPT5ENE3CARBOXYLICACID
3((2((3ethoxyphenyl)carbonyl)hydrazinyl)carbonyl)bicyclo(221)hept5ene2carboxylicacid
3((2(3ETHOXYBENZOYL)HYDRAZINO)CARBONYL)BICYCLO(221)HEPT5ENE2CARBOXYLICACID
3(N((3ETHOXYPHENYL)CARBONYLAMINO)CARBAMOYL)BICYCLO(221)HEPT5ENE2CARBOXYLICACID
CCOC1=CC=CC(=C1)C(=O)NNC(=O)C2C3CC(C2C(=O)O)C=C3
InChI=1SC18H20N2O5c12251353412(913)16(21)192017(22)14106711(810)15(14)18(23)24h379111415H28H21H3(H1921)(H2022)(H2324)
MFCD03234190
ZINC000102201916
ZINC000239174042

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Available files

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