2-[[3-bromanyl-4-[(4-chlorophenyl)methoxy]-5-ethoxy-phenyl]methylidene]indene-1,3-dione

Systemtic Name: 2-[[3-bromanyl-4-[(4-chlorophenyl)methoxy]-5-ethoxy-phenyl]methylidene]indene-1,3-dione Openeye Name: 2-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxy-phenyl]methylene]indane-1,3-dione CAS Name: 2-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxyphenyl]methylidene]indene-1,3-dione IUPAC Name: 2-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxyphenyl]methylidene]indene-1,3-dione Traditional Name: 2-[3-bromo-4-(4-chlorobenzyl)oxy-5-ethoxy-benzylidene]indane-1,3-quinone Formula: C25H18BrClO4 MolecularWeight: 497.76502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)C3=CC=CC=C3C2=O)Br)OCC4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C2C(=O)C3=CC=CC=C3C2=O)Br)OCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H18BrClO4/c1-2-30-22-13-16(11-20-23(28)18-5-3-4-6-19(18)24(20)29)12-21(26)25(22)31-14-15-7-9-17(27)10-8-15/h3-13H,2,14H2,1H3