Vitas-M small molecule compound
3-{[4-(4-chlorophenyl)piperazin-1-yl]carbonyl}-6-nitro-2H-chromen-2-one
Catalog ID
STK464478
SMILES Clc1ccc(cc1)N1CCN(CC1)C(=O)c1cc2cc(ccc2oc1=O)[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 C20H16ClN3O5 MW 413.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16ClN3O5/c21-14-1-3-15(4-2-14)22-7-9-23(10-8-22)19(25)17-12-13-11-16(24(27)28)5-6-18(13)29-20(17)26/h1-6,11-12H,7-10H2InChIKey
SCHIBCMUHRJKBE-UHFFFAOYSA-NSynonyms
3((4(4chlorophenyl)piperazin1yl)carbonyl)6nitro2Hchromen2one
3((4(4CHLOROPHENYL)PIPERAZINYL)CARBONYL)6NITROCHROMEN2ONE
3(4(4CHLOROPHENYL)PIPERAZINE1CARBONYL)6NITROCHROMEN2ONE
C1CN(CCN1C2=CC=C(C=C2)Cl)C(=O)C3=CC4=C(C=CC(=C4)(N+)(=O)(O))OC3=O
Clc1ccc(cc1)N1CCN(CC1)C(=O)c1cc2cc(ccc2oc1=O)(N+)(=O)(O)
InChI=1SC20H16ClN3O5c21141315(4214)227923(10822)19(25)1712131116(24(27)28)5618(13)2920(17)26h161112H710H2
MFCD06625009
ZINC000001055451
ZINC01055451
ZINC1055451
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