(E)-3-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)-1-(3-fluoranyl-4-pyrrolidin-1-yl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)-1-(3-fluoranyl-4-pyrrolidin-1-yl-phenyl)prop-2-en-1-one Openeye Name: (E)-3-(3-chloro-4-hydroxy-5-methoxy-phenyl)-1-(3-fluoro-4-pyrrolidin-1-yl-phenyl)prop-2-en-1-one CAS Name: (E)-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-1-[3-fluoro-4-(1-pyrrolidinyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-1-(3-fluoro-4-pyrrolidin-1-ylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(3-chloro-4-hydroxy-5-methoxy-phenyl)-1-(3-fluoro-4-pyrrolidino-phenyl)prop-2-en-1-one Formula: C20H19ClFNO3 MolecularWeight: 375.821163

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)C2=CC(=C(C=C2)N3CCCC3)F)Cl)O

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/C(=O)C2=CC(=C(C=C2)N3CCCC3)F)Cl)O

InChI

InChI=1S/C20H19ClFNO3/c1-26-19-11-13(10-15(21)20(19)25)4-7-18(24)14-5-6-17(16(22)12-14)23-8-2-3-9-23/h4-7,10-12,25H,2-3,8-9H2,1H3/b7-4+