Vitas-M small molecule compound

2-(4-methylphenyl)-2-oxoethyl 3-{[(3-nitrophenyl)carbonyl]amino}benzoate

Catalog ID
STK268526
SMILES Cc1ccc(cc1)C(=O)COC(=O)c1cccc(c1)NC(=O)c1cccc(c1)[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 C23H18N2O6 MW 418.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N2O6/c1-15-8-10-16(11-9-15)21(26)14-31-23(28)18-5-2-6-19(12-18)24-22(27)17-4-3-7-20(13-17)25(29)30/h2-13H,14H2,1H3,(H,24,27)
InChIKey
VRUQVIQVCCIVOD-UHFFFAOYSA-N
Synonyms

(2(4METHYLPHENYL)2OXOETHYL)3((3NITROBENZOYL)AMINO)BENZOATE
2(4methylphenyl)2oxoethyl3(((3nitrophenyl)carbonyl)amino)benzoate
2(4METHYLPHENYL)2OXOETHYL3((3NITROBENZOYL)AMINO)BENZOATE
2(4METHYLPHENYL)2OXOETHYL3((3NITROPHENYL)CARBONYLAMINO)BENZOATE
CC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)(N+)(=O)(O)
Cc1ccc(cc1)C(=O)COC(=O)c1cccc(c1)NC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC23H18N2O6c11581016(11915)21(26)143123(28)1852619(1218)2422(27)1743720(1317)25(29)30h213H14H21H3(H2427)
MFCD01174277
ZINC000000990464
ZINC00990464
ZINC990464

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Available files

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