Vitas-M small molecule compound
3-[(3-nitrophenyl)amino]cyclohex-2-en-1-one
Catalog ID
STK897874
SMILES O=C1CCCC(=C1)Nc1cccc(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 C12H12N2O3 MW 232.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N2O3/c15-12-6-2-4-10(8-12)13-9-3-1-5-11(7-9)14(16)17/h1,3,5,7-8,13H,2,4,6H2InChIKey
XSKKZXQWMQORFT-UHFFFAOYSA-NSynonyms
168564-50-91(3NITROANILINO)1CYCLOHEXEN3ONE
168564509
3((3nitrophenyl)amino)cyclohex2en1one
3(3NITROANILINO)CYCLOHEX2EN1ONE
C1CC(=CC(=O)C1)NC2=CC(=CC=C2)(N+)(=O)(O)
InChI=1SC12H12N2O3c151262410(812)13931511(79)14(16)17h1357813H246H2
MFCD01109152
O=C1CCCC(=C1)Nc1cccc(c1)(N+)(=O)(O)
ZINC000004235210
ZINC04235210
ZINC4235210
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