Vitas-M small molecule compound

methyl 1-[(4-nitrophenyl)carbonyl]-1H-indole-3-carboxylate

Catalog ID
STK873363
SMILES COC(=O)c1cn(c2c1cccc2)C(=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 C17H12N2O5 MW 324.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12N2O5/c1-24-17(21)14-10-18(15-5-3-2-4-13(14)15)16(20)11-6-8-12(9-7-11)19(22)23/h2-10H,1H3
InChIKey
WIYUQIAVNMPNNF-UHFFFAOYSA-N
Synonyms
393124-09-9
393124099
COC(=O)C1=CN(C2=CC=CC=C21)C(=O)C3=CC=C(C=C3)(N+)(=O)(O)
COC(=O)c1cn(c2c1cccc2)C(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC17H12N2O5c12417(21)141018(15532413(14)15)16(20)116812(9711)19(22)23h210H1H3
methyl1((4nitrophenyl)carbonyl)1Hindole3carboxylate
METHYL1((4NITROPHENYL)CARBONYL)INDOLE3CARBOXYLATE
methyl1(4nitrobenzoyl)1Hindole3carboxylate
METHYL1(4NITROBENZOYL)INDOLE3CARBOXYLATE
MFCD01611875
ZINC000000455338
ZINC00455338
ZINC455338

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Available files

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