Vitas-M small molecule compound
3-benzyl-3,4,7,8,9,10-hexahydro-2H,6H-benzo[3,4]chromeno[8,7-e][1,3]oxazin-6-one
Catalog ID
STL226307
SMILES O=c1oc2c3CN(COc3ccc2c2c1CCCC2)Cc1ccccc1
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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 C22H21NO3 MW 347.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO3/c24-22-18-9-5-4-8-16(18)17-10-11-20-19(21(17)26-22)13-23(14-25-20)12-15-6-2-1-3-7-15/h1-3,6-7,10-11H,4-5,8-9,12-14H2InChIKey
JUJZAJOOKRHRSH-UHFFFAOYSA-NSynonyms
849005-83-03benzyl2478910hexahydroisochromeno(34f)(13)benzoxazin6one
3benzyl3478910hexahydro2H6Hbenzo(34)chromeno(87e)(13)oxazin6one
3benzyl3478910hexahydrobenzo(34)chromeno(87e)(13)oxazin6(2H)one
849005830
C1CCC2=C(C1)C3=C(C4=C(C=C3)OCN(C4)CC5=CC=CC=C5)OC2=O
InChI=1SC22H21NO3c242218954816(18)1710112019(21(17)2622)1323(142520)12156213715h13671011H45891214H2
MFCD05680238
ZINC000055393824
ZINC55393824
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