2-[[3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylidene]-1-benzothiophen-3-one

Systemtic Name: 2-[[3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylidene]-1-benzothiophen-3-one Openeye Name: 2-[[3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylene]benzothiophen-3-one CAS Name: 2-[[3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylidene]-1-benzothiophen-3-one IUPAC Name: 2-[[3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylidene]-1-benzothiophen-3-one Traditional Name: 2-[3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzylidene]benzothiophen-3-one Formula: C23H14F3NO5S MolecularWeight: 473.42117

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=O)C3=CC=CC=C3S2)OC4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C=C2C(=O)C3=CC=CC=C3S2)OC4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C23H14F3NO5S/c1-31-19-10-13(11-21-22(28)15-4-2-3-5-20(15)33-21)6-8-18(19)32-17-9-7-14(23(24,25)26)12-16(17)27(29)30/h2-12H,1H3