Vitas-M small molecule compound
2-amino-4-(4-methoxyphenyl)-7,7-dimethyl-3-nitro-4,6,7,8-tetrahydro-5H-chromen-5-one
Catalog ID
STK748607
SMILES COc1ccc(cc1)C1C2=C(OC(=C1[N+](=O)[O-])N)CC(CC2=O)(C)C
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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 C18H20N2O5 MW 344.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O5/c1-18(2)8-12(21)15-13(9-18)25-17(19)16(20(22)23)14(15)10-4-6-11(24-3)7-5-10/h4-7,14H,8-9,19H2,1-3H3InChIKey
AYYDFUBBFZIMMF-UHFFFAOYSA-NSynonyms
107693-21-0107693210
2amino4(4methoxyphenyl)77dimethyl3nitro4678tetrahydro5Hchromen5one
2AMINO4(4METHOXYPHENYL)77DIMETHYL3NITRO68DIHYDRO4HCHROMEN5ONE
2amino4(4methoxyphenyl)77dimethyl3nitro78dihydro4Hchromen5(6H)one
CC1(CC2=C(C(C(=C(O2)N)(N+)(=O)(O))C3=CC=C(C=C3)OC)C(=O)C1)C
COc1ccc(cc1)C1C2=C(OC(=C1(N+)(=O)(O))N)CC(CC2=O)(C)C
InChI=1SC18H20N2O5c118(2)812(21)1513(918)2517(19)16(20(22)23)14(15)104611(243)7510h4714H8919H213H3
MFCD00743568
ZINC000000050123
ZINC000002255587
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