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

Systemtic Name: 2-[(2-bromanyl-4-butoxy-5-ethoxy-phenyl)methylidene]indene-1,3-dione Openeye Name: 2-[(2-bromo-4-butoxy-5-ethoxy-phenyl)methylene]indane-1,3-dione CAS Name: 2-[(2-bromo-4-butoxy-5-ethoxyphenyl)methylidene]indene-1,3-dione IUPAC Name: 2-[(2-bromo-4-butoxy-5-ethoxyphenyl)methylidene]indene-1,3-dione Traditional Name: 2-(2-bromo-4-butoxy-5-ethoxy-benzylidene)indane-1,3-quinone Formula: C22H21BrO4 MolecularWeight: 429.30374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C(=C1)Br)C=C2C(=O)C3=CC=CC=C3C2=O)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C(=C1)Br)C=C2C(=O)C3=CC=CC=C3C2=O)OCC

InChI

InChI=1S/C22H21BrO4/c1-3-5-10-27-20-13-18(23)14(12-19(20)26-4-2)11-17-21(24)15-8-6-7-9-16(15)22(17)25/h6-9,11-13H,3-5,10H2,1-2H3