Vitas-M small molecule compound

3-[(1E)-2-nitroprop-1-en-1-yl]-1H-indole

Catalog ID
STK386853
SMILES [O-][N+](=O)/C(=C/c1c[nH]c2c1cccc2)/C

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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 C11H10N2O2 MW 202.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H10N2O2/c1-8(13(14)15)6-9-7-12-11-5-3-2-4-10(9)11/h2-7,12H,1H3/b8-6+
InChIKey
BPAQTDYDNBMYAM-SOFGYWHQSA-N
Synonyms
84584-89-4
(O)(N+)(=O)C(=Cc1c(nH)c2c1cccc2)C
(Z)3(2nitroprop1en1yl)1Hindole
1HINDOLE3((1E)2NITRO1PROPENYL)
1INDYL2NITROPROPENE
3((1E)2NITROPROP1EN1YL)1HINDOLE
3((1E)2NITROPROP1ENYL)INDOLE
3((E)2NITRO1PROPENYL)1HINDOLE
3((E)2NITROPROP1ENYL)1HINDOLE
3(2METHYL2NITROVINYL)INDOLE
3(2NITRO1PROPENYL)INDOLE
3(2NITROPROPENYL)1HINDOLE
84584894
CC(=CC1=CNC2=CC=CC=C21)(N+)(=O)(O)
InChI=1SC11H10N2O2c18(13(14)15)6971211532410(9)11h2712H1H3b86+
MFCD00022747
ZINC000004539049
ZINC04539049
ZINC4539049

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Available files

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