Vitas-M small molecule compound
4-({[(2-{[(4-nitrophenyl)carbonyl]amino}phenyl)carbonyl]oxy}acetyl)phenyl furan-2-carboxylate
Catalog ID
STK290224
SMILES O=C(c1ccc(cc1)OC(=O)c1ccco1)COC(=O)c1ccccc1NC(=O)c1ccc(cc1)[N+](=O)[O-]
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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 C27H18N2O9 MW 514.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18N2O9/c30-23(17-9-13-20(14-10-17)38-27(33)24-6-3-15-36-24)16-37-26(32)21-4-1-2-5-22(21)28-25(31)18-7-11-19(12-8-18)29(34)35/h1-15H,16H2,(H,28,31)InChIKey
CCBHQSOEDIPFMB-UHFFFAOYSA-NSynonyms
(4(2(2((4NITROBENZOYL)AMINO)BENZOYL)OXYACETYL)PHENYL)FURAN2CARBOXYLATE
4((((2(((4nitrophenyl)carbonyl)amino)phenyl)carbonyl)oxy)acetyl)phenylfuran2carboxylate
4(2(2((4NITROPHENYL)CARBONYLAMINO)PHENYLCARBONYLOXY)ACETYL)PHENYLFURAN2CARBOXYLATE
C1=CC=C(C(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)OC(=O)C3=CC=CO3)NC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC27H18N2O9c3023(1791320(141017)3827(33)2463153624)163726(32)21412522(21)2825(31)1871119(12818)29(34)35h115H16H2(H2831)
MFCD03849347
O=C(c1ccc(cc1)OC(=O)c1ccco1)COC(=O)c1ccccc1NC(=O)c1ccc(cc1)(N+)(=O)(O)
ZINC000009543580
ZINC09543580
ZINC9543580
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