Vitas-M small molecule compound

4-[(3-methylpiperidinium-1-yl)methyl]-6-oxo-6H-benzo[c]chromen-3-olate

Catalog ID
STK562302
SMILES CC1CCC[NH+](C1)Cc1c([O-])ccc2c1oc(=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 C20H21NO3 MW 323.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO3/c1-13-5-4-10-21(11-13)12-17-18(22)9-8-15-14-6-2-3-7-16(14)20(23)24-19(15)17/h2-3,6-9,13,22H,4-5,10-12H2,1H3
InChIKey
KGRWBLYBFJAAAY-UHFFFAOYSA-N
Synonyms
841206-15-3
3HYDROXY4((3METHYLPIPERIDIN1YL)METHYL)BENZO(C)CHROMEN6ONE
4((3METHYLPIPERIDIN1IUM1YL)METHYL)6OXOBENZO(C)CHROMEN3OLATE
4((3methylpiperidinium1yl)methyl)6oxo6Hbenzo(c)chromen3olate
841206153
CC1CCC(NH+)(C1)CC2=C(C=CC3=C2OC(=O)C4=CC=CC=C34)(O)
InChI=1SC20H21NO3c113541021(1113)121718(22)981514623716(14)20(23)2419(15)17h23691322H451012H21H3
MFCD04011079
ZINC000013510942
ZINC000013510944

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Available files

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