Vitas-M small molecule compound

6-amino-8-(3-nitrophenyl)-8H-[1,3]dioxolo[4,5-g]chromene-7-carbonitrile

Catalog ID
STL375690
SMILES N#CC1=C(N)Oc2c(C1c1cccc(c1)[N+](=O)[O-])cc1c(c2)OCO1

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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 C17H11N3O5 MW 337.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11N3O5/c18-7-12-16(9-2-1-3-10(4-9)20(21)22)11-5-14-15(24-8-23-14)6-13(11)25-17(12)19/h1-6,16H,8,19H2
InChIKey
ZKDONWIIAAEZBH-UHFFFAOYSA-N
Synonyms

6amino8(3nitrophenyl)8H(13)dioxolo(45g)chromene7carbonitrile
C1OC2=C(O1)C=C3C(=C2)C(C(=C(O3)N)C#N)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC17H11N3O5c1871216(921310(49)20(21)22)1151415(2482314)613(11)2517(12)19h1616H819H2
MFCD05816073
N#CC1=C(N)Oc2c(C1c1cccc(c1)(N+)(=O)(O))cc1c(c2)OCO1
ZINC000000470404
ZINC000000470405

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Available files

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