CAS 2987884-27-3 is the registry number for COMT-IN-1. Offered by: MedChemExpress. Available pack sizes: Get quote.
(E)-2-cyano-3-(3,4-dihydroxy-5-nitrophenyl)-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]prop-2-enamide (CAS 2987884-27-3) is a chemical compound with the molecular formula C24H18FN3O6 and a molecular weight of 463.4 g/mol. IUPAC name: (E)-2-cyano-3-(3,4-dihydroxy-5-nitrophenyl)-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]prop-2-enamide. InChIKey: XAPJLOSBUMRSAQ-QGMBQPNBSA-N.
| Molecular formula | C24H18FN3O6 |
|---|---|
| Molecular weight | 463.4 g/mol |
| IUPAC name | (E)-2-cyano-3-(3,4-dihydroxy-5-nitrophenyl)-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]prop-2-enamide |
| InChIKey | XAPJLOSBUMRSAQ-QGMBQPNBSA-N |
| SMILES | C1=CC(=CC(=C1)F)COC2=CC=C(C=C2)CNC(=O)/C(=C/C3=CC(=C(C(=C3)O)O)[N+](=O)[O-])/C#N |
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