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

Systemtic Name: 2-[(3-bromanyl-5-methoxy-4-propoxy-phenyl)methylidene]indene-1,3-dione Openeye Name: 2-[(3-bromo-5-methoxy-4-propoxy-phenyl)methylene]indane-1,3-dione CAS Name: 2-[(3-bromo-5-methoxy-4-propoxyphenyl)methylidene]indene-1,3-dione IUPAC Name: 2-[(3-bromo-5-methoxy-4-propoxyphenyl)methylidene]indene-1,3-dione Traditional Name: 2-(3-bromo-5-methoxy-4-propoxy-benzylidene)indane-1,3-quinone Formula: C20H17BrO4 MolecularWeight: 401.25058

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C=C2C(=O)C3=CC=CC=C3C2=O)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)C=C2C(=O)C3=CC=CC=C3C2=O)OC

InChI

InChI=1S/C20H17BrO4/c1-3-8-25-20-16(21)10-12(11-17(20)24-2)9-15-18(22)13-6-4-5-7-14(13)19(15)23/h4-7,9-11H,3,8H2,1-2H3