Vitas-M small molecule compound

2-[(4-chlorophenyl)amino]-2-oxoethyl isoquinoline-1-carboxylate

Catalog ID
STL186988
SMILES O=C(Nc1ccc(cc1)Cl)COC(=O)c1nccc2c1cccc2

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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 C18H13ClN2O3 MW 340.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13ClN2O3/c19-13-5-7-14(8-6-13)21-16(22)11-24-18(23)17-15-4-2-1-3-12(15)9-10-20-17/h1-10H,11H2,(H,21,22)
InChIKey
PDGDAPOISGXAJQ-UHFFFAOYSA-N
Synonyms

(2(4chloroanilino)2oxoethyl)isoquinoline1carboxylate
2((4chlorophenyl)amino)2oxoethylisoquinoline1carboxylate
C1=CC=C2C(=C1)C=CN=C2C(=O)OCC(=O)NC3=CC=C(C=C3)Cl
InChI=1SC18H13ClN2O3c19135714(8613)2116(22)112418(23)1715421312(15)9102017h110H11H2(H2122)
MFCD22387995
ZINC000064875142
ZINC64875142

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Available files

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