Vitas-M small molecule compound
N-[2-(carboxymethyl)-5-nitro-1,3-dioxo-2,3-dihydro-1H-benzo[de]isoquinolin-6-yl]glycine
Catalog ID
STL295505
SMILES OC(=O)CNc1c(cc2c3c1cccc3c(=O)n(c2=O)CC(=O)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 C16H11N3O8 MW 373.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11N3O8/c20-11(21)5-17-14-7-2-1-3-8-13(7)9(4-10(14)19(26)27)16(25)18(15(8)24)6-12(22)23/h1-4,17H,5-6H2,(H,20,21)(H,22,23)InChIKey
INHPPRQIIJRRHW-UHFFFAOYSA-NSynonyms
2((2(carboxymethyl)5nitro13dioxobenzo(de)isoquinolin6yl)amino)aceticacid
C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC(=C2NCC(=O)O)(N+)(=O)(O))CC(=O)O
InChI=1SC16H11N3O8c2011(21)517147213813(7)9(410(14)19(26)27)16(25)18(15(8)24)612(22)23h1417H56H2(H2021)(H2223)
MFCD27966448
N(2(carboxymethyl)5nitro13dioxo23dihydro1Hbenzo(de)isoquinolin6yl)glycine
OC(=O)CNc1c(cc2c3c1cccc3c(=O)n(c2=O)CC(=O)O)(N+)(=O)(O)
ZINC000095471035
ZINC95471035
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