Vitas-M small molecule compound
5-(4-methoxy-3-nitrophenyl)-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Catalog ID
STK374527
SMILES COc1ccc(cc1[N+](=O)[O-])C1Nc2ccc3c(c2C2=C1C(=O)CC(C2)(C)C)cccc3
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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 C26H24N2O4 MW 428.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O4/c1-26(2)13-18-23-17-7-5-4-6-15(17)8-10-19(23)27-25(24(18)21(29)14-26)16-9-11-22(32-3)20(12-16)28(30)31/h4-12,25,27H,13-14H2,1-3H3InChIKey
CERUAOPVNNYCQJ-UHFFFAOYSA-NSynonyms
5(4methoxy3nitrophenyl)22dimethyl1356tetrahydrobenzo(a)phenanthridin4one
5(4methoxy3nitrophenyl)22dimethyl2356tetrahydrobenzo(a)phenanthridin4(1H)one
CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC(=C(C=C5)OC)(N+)(=O)(O))C(=O)C1)C
COc1ccc(cc1(N+)(=O)(O))C1Nc2ccc3c(c2C2=C1C(=O)CC(C2)(C)C)cccc3
InChI=1SC26H24N2O4c126(2)13182317754615(17)81019(23)2725(24(18)21(29)1426)1691122(323)20(1216)28(30)31h4122527H1314H213H3
MFCD01029860
ZINC000000832973
ZINC000000832974
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