Vitas-M small molecule compound
2-chloro-4-[(cyclopropylammonio)methyl]-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-olate
Catalog ID
STK622983
SMILES [O-]c1c(Cl)cc2c(c1C[NH2+]C1CC1)oc(=O)c1c2CCCC1
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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 C17H18ClNO3 MW 319.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18ClNO3/c18-14-7-12-10-3-1-2-4-11(10)17(21)22-16(12)13(15(14)20)8-19-9-5-6-9/h7,9,19-20H,1-6,8H2InChIKey
OWSOTQQCYWWPJA-UHFFFAOYSA-NSynonyms
(O)c1c(Cl)cc2c(c1C(NH2+)C1CC1)oc(=O)c1c2CCCC1
2chloro4((cyclopropylammonio)methyl)6oxo78910tetrahydro6Hbenzo(c)chromen3olate
2chloro4((cyclopropylazaniumyl)methyl)6oxo78910tetrahydrobenzo(c)chromen3olate
C1CCC2=C(C1)C3=CC(=C(C(=C3OC2=O)C(NH2+)C4CC4)(O))Cl
InChI=1SC17H18ClNO3c181471210312411(10)17(21)2216(12)13(15(14)20)8199569h791920H168H2
MFCD09844976
ZINC000020646779
ZINC20646779
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