Vitas-M small molecule compound
8-[(4-nitrophenyl)carbamoyl]tribenzo[b,e,g][1,4]dioxocine-7-carboxylic acid
Catalog ID
STL015596
SMILES OC(=O)c1cc2oc3ccccc3c3c(oc2cc1C(=O)Nc1ccc(cc1)[N+](=O)[O-])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 C26H16N2O7 MW 468.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H16N2O7/c29-25(27-15-9-11-16(12-10-15)28(32)33)19-13-23-24(14-20(19)26(30)31)35-22-8-4-2-6-18(22)17-5-1-3-7-21(17)34-23/h1-14H,(H,27,29)(H,30,31)InChIKey
YMBIHYXWSROERI-UHFFFAOYSA-NSynonyms
516467-96-2516467962
8((4nitrophenyl)carbamoyl)tribenzo(beg)(14)dioxocine7carboxylicacid
C1=CC=C2C(=C1)C3=CC=CC=C3OC4=C(O2)C=C(C(=C4)C(=O)O)C(=O)NC5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC26H16N2O7c2925(271591116(121015)28(32)33)19132324(1420(19)26(30)31)3522842618(22)17513721(17)3423h114H(H2729)(H3031)
MFCD03689870
OC(=O)c1cc2oc3ccccc3c3c(oc2cc1C(=O)Nc1ccc(cc1)(N+)(=O)(O))cccc3
ZINC000008994587
ZINC8994587
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