Vitas-M small molecule compound

3-nitro-2-[(3-nitrophenyl)carbamoyl]benzoic acid

Catalog ID
STK368957
SMILES [O-][N+](=O)c1cccc(c1)NC(=O)c1c(cccc1C(=O)O)[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 C14H9N3O7 MW 331.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H9N3O7/c18-13(15-8-3-1-4-9(7-8)16(21)22)12-10(14(19)20)5-2-6-11(12)17(23)24/h1-7H,(H,15,18)(H,19,20)
InChIKey
NSJWVLQJKXAOES-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1cccc(c1)NC(=O)c1c(cccc1C(=O)O)(N+)(=O)(O)
3nitro2((3nitrophenyl)carbamoyl)benzoicacid
3NITRO2(N(3NITROPHENYL)CARBAMOYL)BENZOICACID
C1=CC(=CC(=C1)(N+)(=O)(O))NC(=O)C2=C(C=CC=C2(N+)(=O)(O))C(=O)O
InChI=1SC14H9N3O7c1813(1583149(78)16(21)22)1210(14(19)20)52611(12)17(23)24h17H(H1518)(H1920)
MFCD00391801
ZINC000002923754
ZINC2923754

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Available files

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