Vitas-M small molecule compound

methyl {1-[(4-nitrophenyl)carbonyl]-3-oxopiperazin-2-yl}acetate

Catalog ID
STK896769
SMILES COC(=O)CC1C(=O)NCCN1C(=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 C14H15N3O6 MW 321.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15N3O6/c1-23-12(18)8-11-13(19)15-6-7-16(11)14(20)9-2-4-10(5-3-9)17(21)22/h2-5,11H,6-8H2,1H3,(H,15,19)
InChIKey
BQZJCPDSIGSGTI-UHFFFAOYSA-N
Synonyms

COC(=O)CC1C(=O)NCCN1C(=O)c1ccc(cc1)(N+)(=O)(O)
COC(=O)CC1C(=O)NCCN1C(=O)C2=CC=C(C=C2)(N+)(=O)(O)
InChI=1SC14H15N3O6c12312(18)81113(19)156716(11)14(20)92410(539)17(21)22h2511H68H21H3(H1519)
methyl(1((4nitrophenyl)carbonyl)3oxopiperazin2yl)acetate
METHYL(1(4NITROBENZOYL)3OXOPIPERAZIN2YL)ACETATE
METHYL2(1(4NITROBENZOYL)3OXOPIPERAZIN2YL)ACETATE
MFCD03029110
ZINC000000307816
ZINC000000307818

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.