Vitas-M small molecule compound
2,2-dimethyl-5-(4-methyl-3-nitrophenyl)-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Catalog ID
STK374614
SMILES O=C1CC(C)(C)CC2=C1C(Nc1c2c2ccccc2cc1)c1ccc(c(c1)[N+](=O)[O-])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 C26H24N2O3 MW 412.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O3/c1-15-8-9-17(12-21(15)28(30)31)25-24-19(13-26(2,3)14-22(24)29)23-18-7-5-4-6-16(18)10-11-20(23)27-25/h4-12,25,27H,13-14H2,1-3H3InChIKey
UHSLBYVSVQRGIY-UHFFFAOYSA-NSynonyms
22dimethyl5(4methyl3nitrophenyl)1356tetrahydrobenzo(a)phenanthridin4one
22dimethyl5(4methyl3nitrophenyl)2356tetrahydrobenzo(a)phenanthridin4(1H)one
CC1=C(C=C(C=C1)C2C3=C(CC(CC3=O)(C)C)C4=C(N2)C=CC5=CC=CC=C54)(N+)(=O)(O)
InChI=1SC26H24N2O3c1158917(1221(15)28(30)31)252419(1326(23)1422(24)29)2318754616(18)101120(23)2725h4122527H1314H213H3
MFCD01052054
O=C1CC(C)(C)CC2=C1C(Nc1c2c2ccccc2cc1)c1ccc(c(c1)(N+)(=O)(O))C
ZINC000000854415
ZINC000000854416
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