3-(3-bromanyl-4-fluoranyl-phenyl)-1-[2-[(4-ethanoyl-3-methyl-phenoxy)methyl]morpholin-4-yl]prop-2-en-1-one

Systemtic Name: 3-(3-bromanyl-4-fluoranyl-phenyl)-1-[2-[(4-ethanoyl-3-methyl-phenoxy)methyl]morpholin-4-yl]prop-2-en-1-one Openeye Name: 1-[2-[(4-acetyl-3-methyl-phenoxy)methyl]morpholin-4-yl]-3-(3-bromo-4-fluoro-phenyl)prop-2-en-1-one CAS Name: 1-[2-[(4-acetyl-3-methylphenoxy)methyl]-4-morpholinyl]-3-(3-bromo-4-fluorophenyl)-2-propen-1-one IUPAC Name: 1-[2-[(4-acetyl-3-methylphenoxy)methyl]morpholin-4-yl]-3-(3-bromo-4-fluorophenyl)prop-2-en-1-one Traditional Name: 1-[2-[(4-acetyl-3-methyl-phenoxy)methyl]morpholino]-3-(3-bromo-4-fluoro-phenyl)prop-2-en-1-one Formula: C23H23BrFNO4 MolecularWeight: 476.335423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2CN(CCO2)C(=O)C=CC3=CC(=C(C=C3)F)Br)C(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2CN(CCO2)C(=O)C=CC3=CC(=C(C=C3)F)Br)C(=O)C

InChI

InChI=1S/C23H23BrFNO4/c1-15-11-18(5-6-20(15)16(2)27)30-14-19-13-26(9-10-29-19)23(28)8-4-17-3-7-22(25)21(24)12-17/h3-8,11-12,19H,9-10,13-14H2,1-2H3