(2Z)-2-[[3-bromanyl-4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-1-benzothiophen-3-one

Systemtic Name: (2Z)-2-[[3-bromanyl-4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-1-benzothiophen-3-one Openeye Name: (2Z)-2-[[3-bromo-4-[(4-nitrophenyl)methoxy]phenyl]methylene]benzothiophen-3-one CAS Name: (2Z)-2-[[3-bromo-4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-1-benzothiophen-3-one IUPAC Name: (2Z)-2-[[3-bromo-4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-1-benzothiophen-3-one Traditional Name: (2Z)-2-[3-bromo-4-(4-nitrobenzyl)oxy-benzylidene]benzothiophen-3-one Formula: C22H14BrNO4S MolecularWeight: 468.31986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=CC3=CC(=C(C=C3)OCC4=CC=C(C=C4)[N+](=O)[O-])Br)S2

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)/C(=C/C3=CC(=C(C=C3)OCC4=CC=C(C=C4)[N+](=O)[O-])Br)/S2

InChI

InChI=1S/C22H14BrNO4S/c23-18-11-15(12-21-22(25)17-3-1-2-4-20(17)29-21)7-10-19(18)28-13-14-5-8-16(9-6-14)24(26)27/h1-12H,13H2/b21-12-