Vitas-M small molecule compound
1,4-dioxo-3-phenyl-1,4-dihydronaphthalen-2-yl 3-nitrobenzoate
Catalog ID
STK138362
SMILES O=C(c1cccc(c1)[N+](=O)[O-])OC1=C(c2ccccc2)C(=O)c2c(C1=O)cccc2
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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 C23H13NO6 MW 399.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H13NO6/c25-20-17-11-4-5-12-18(17)21(26)22(19(20)14-7-2-1-3-8-14)30-23(27)15-9-6-10-16(13-15)24(28)29/h1-13HInChIKey
SRVKFRCQSKJYGS-UHFFFAOYSA-NSynonyms
(14DIOXO3PHENYLNAPHTHALEN2YL)3NITROBENZOATE
14DIOXO3PHENYL14DIHYDRONAPHTHALEN2YL3NITROBENZOATE
14DIOXO3PHENYL2NAPHTHYL3NITROBENZOATE
C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3C2=O)OC(=O)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC23H13NO6c25201711451218(17)21(26)22(19(20)147213814)3023(27)15961016(1315)24(28)29h113H
MFCD01171581
O=C(c1cccc(c1)(N+)(=O)(O))OC1=C(c2ccccc2)C(=O)c2c(C1=O)cccc2
ZINC000004681793
ZINC04681793
ZINC4681793
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