Vitas-M small molecule compound

(2Z)-2-(4,5-dimethoxy-2-nitrophenyl)-3-(1H-indol-3-yl)prop-2-enenitrile

Catalog ID
STK536613
SMILES N#C/C(=C\c1c[nH]c2c1cccc2)/c1cc(OC)c(cc1[N+](=O)[O-])OC

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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 C19H15N3O4 MW 349.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N3O4/c1-25-18-8-15(17(22(23)24)9-19(18)26-2)12(10-20)7-13-11-21-16-6-4-3-5-14(13)16/h3-9,11,21H,1-2H3/b12-7+
InChIKey
AKPJBFZHVLHHAA-KPKJPENVSA-N
Synonyms
332030-54-3
(2Z)2(45dimethoxy2nitrophenyl)3(1Hindol3yl)prop2enenitrile
(Z)2(45dimethoxy2nitrophenyl)3(1Hindol3yl)acrylonitrile
(Z)2(45DIMETHOXY2NITROPHENYL)3(1HINDOL3YL)PROP2ENENITRILE
332030543
COC1=C(C=C(C(=C1)C(=CC2=CNC3=CC=CC=C32)C#N)(N+)(=O)(O))OC
InChI=1SC19H15N3O4c12518815(17(22(23)24)919(18)262)12(1020)713112116643514(13)16h391121H12H3b127+
MFCD01088116
N#CC(=Cc1c(nH)c2c1cccc2)c1cc(OC)c(cc1(N+)(=O)(O))OC
ZINC000000500529
ZINC00500529
ZINC500529

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Available files

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