Vitas-M small molecule compound
hexyl 4-{[(4-methyl-3-nitrophenyl)carbonyl]amino}benzoate
Catalog ID
STK378993
SMILES CCCCCCOC(=O)c1ccc(cc1)NC(=O)c1ccc(c(c1)[N+](=O)[O-])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 C21H24N2O5 MW 384.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O5/c1-3-4-5-6-13-28-21(25)16-9-11-18(12-10-16)22-20(24)17-8-7-15(2)19(14-17)23(26)27/h7-12,14H,3-6,13H2,1-2H3,(H,22,24)InChIKey
UFKHVDPRPWPUNJ-UHFFFAOYSA-NSynonyms
CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)C)(N+)(=O)(O)
CCCCCCOC(=O)c1ccc(cc1)NC(=O)c1ccc(c(c1)(N+)(=O)(O))C
hexyl4(((4methyl3nitrophenyl)carbonyl)amino)benzoate
HEXYL4((4METHYL3NITROBENZOYL)AMINO)BENZOATE
HEXYL4((4METHYL3NITROPHENYL)CARBONYLAMINO)BENZOATE
InChI=1SC21H24N2O5c13456132821(25)1691118(121016)2220(24)178715(2)19(1417)23(26)27h71214H3613H212H3(H2224)
MFCD01918552
ZINC000001771521
ZINC01771521
ZINC1771521
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