Vitas-M small molecule compound
6-methyl-2-[3-(4-nitrophenoxy)phenyl]-4H-3,1-benzoxazin-4-one
Catalog ID
STK036095
SMILES Cc1ccc2c(c1)c(=O)oc(n2)c1cccc(c1)Oc1ccc(cc1)[N+](=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 C21H14N2O5 MW 374.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14N2O5/c1-13-5-10-19-18(11-13)21(24)28-20(22-19)14-3-2-4-17(12-14)27-16-8-6-15(7-9-16)23(25)26/h2-12H,1H3InChIKey
KLUKQYPRMHOKIK-UHFFFAOYSA-NSynonyms
2(3(4NITROPHENOXY)PHENYL)6METHYL4H31BENZOXAZIN4ONE
6METHYL2(3(4NITROPHENOXY)PHENYL)31BENZOXAZIN4ONE
6METHYL2(3(4NITROPHENOXY)PHENYL)4H31BENZOXAZIN4ONE
6METHYL2(3(4NITROPHENOXY)PHENYL)BENZO(D)13OXAZIN4ONE
CC1=CC2=C(C=C1)N=C(OC2=O)C3=CC(=CC=C3)OC4=CC=C(C=C4)(N+)(=O)(O)
Cc1ccc2c(c1)c(=O)oc(n2)c1cccc(c1)Oc1ccc(cc1)(N+)(=O)(O)
InChI=1SC21H14N2O5c1135101918(1113)21(24)2820(2219)1432417(1214)27168615(7916)23(25)26h212H1H3
MFCD00344130
STK036095
ZINC000000704988
ZINC00704988
ZINC704988
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