Vitas-M small molecule compound
3-(8-bromo-1H-naphtho[1,2-e][1,3]oxazin-2-ium-2(3H)-yl)benzoate
Catalog ID
STL150162
SMILES Brc1ccc2c(c1)ccc1c2C[NH+](CO1)c1cccc(c1)C(=O)[O-]
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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 C19H14BrNO3 MW 384.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14BrNO3/c20-14-5-6-16-12(8-14)4-7-18-17(16)10-21(11-24-18)15-3-1-2-13(9-15)19(22)23/h1-9H,10-11H2,(H,22,23)InChIKey
TXWJTQQVZSMAIR-UHFFFAOYSA-NSynonyms
3(8BROMO13DIHYDROBENZO(F)(13)BENZOXAZIN2YL)BENZOICACID
3(8BROMO1HNAPHTHO(12E)(13)OXAZIN2(3H)YL)BENZOICACID
3(8bromo1Hnaphtho(12e)(13)oxazin2ium2(3H)yl)benzoate
3(8BROMO23DIHYDRO1HBENZO(F)(13)BENZOXAZIN2IUM2YL)BENZOATE
Brc1ccc2c(c1)ccc1c2C(NH+)(CO1)c1cccc(c1)C(=O)(O)
C1C2=C(C=CC3=C2C=CC(=C3)Br)OC(NH+)1C4=CC=CC(=C4)C(=O)(O)
InChI=1SC19H14BrNO3c2014561612(814)471817(16)1021(112418)1531213(915)19(22)23h19H1011H2(H2223)
ZINC000006220741
ZINC6220741
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