Vitas-M small molecule compound
5-(4-methoxyphenyl)-3-[(4-nitrophenyl)amino]cyclohex-2-en-1-one
Catalog ID
STK207188
SMILES COc1ccc(cc1)C1CC(=O)C=C(C1)Nc1ccc(cc1)[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 C19H18N2O4 MW 338.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O4/c1-25-19-8-2-13(3-9-19)14-10-16(12-18(22)11-14)20-15-4-6-17(7-5-15)21(23)24/h2-9,12,14,20H,10-11H2,1H3InChIKey
FWLNTIXIXWTFFC-UHFFFAOYSA-NSynonyms
351013-72-4351013724
5(4METHOXYPHENYL)3((4NITROPHENYL)AMINO)CYCLOHEX2EN1ONE
5(4METHOXYPHENYL)3(4NITROANILINO)CYCLOHEX2EN1ONE
5(4METHOXYPHENYL)3(4NITROPHENYLAMINO)CYCLOHEX2ENONE
COC1=CC=C(C=C1)C2CC(=CC(=O)C2)NC3=CC=C(C=C3)(N+)(=O)(O)
COc1ccc(cc1)C1CC(=O)C=C(C1)Nc1ccc(cc1)(N+)(=O)(O)
InChI=1SC19H18N2O4c125198213(3919)141016(1218(22)1114)20154617(7515)21(23)24h29121420H1011H21H3
MFCD01951336
ZINC000004741412
ZINC000004741413
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