(E)-1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-fluoranyl-4-methoxy-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-fluoranyl-4-methoxy-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-fluoro-4-methoxy-phenyl)prop-2-en-1-one CAS Name: (E)-1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-fluoro-4-methoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-fluoro-4-methoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-fluoro-4-methoxy-phenyl)prop-2-en-1-one Formula: C27H26FNO4 MolecularWeight: 447.498043

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)N2CCC3=CC(=C(C=C3C2C4=CC=CC=C4)OC)OC)F

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)N2CCC3=CC(=C(C=C3C2C4=CC=CC=C4)OC)OC)F

InChI

InChI=1S/C27H26FNO4/c1-31-23-11-9-18(15-22(23)28)10-12-26(30)29-14-13-20-16-24(32-2)25(33-3)17-21(20)27(29)19-7-5-4-6-8-19/h4-12,15-17,27H,13-14H2,1-3H3/b12-10+