2-[(3-butoxy-4-methoxy-phenyl)methylidene]indene-1,3-dione

Systemtic Name: 2-[(3-butoxy-4-methoxy-phenyl)methylidene]indene-1,3-dione Openeye Name: 2-[(3-butoxy-4-methoxy-phenyl)methylene]indane-1,3-dione CAS Name: 2-[(3-butoxy-4-methoxyphenyl)methylidene]indene-1,3-dione IUPAC Name: 2-[(3-butoxy-4-methoxyphenyl)methylidene]indene-1,3-dione Traditional Name: 2-(3-butoxy-4-methoxy-benzylidene)indane-1,3-quinone Formula: C21H20O4 MolecularWeight: 336.3811

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)C=C2C(=O)C3=CC=CC=C3C2=O)OC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)C=C2C(=O)C3=CC=CC=C3C2=O)OC

InChI

InChI=1S/C21H20O4/c1-3-4-11-25-19-13-14(9-10-18(19)24-2)12-17-20(22)15-7-5-6-8-16(15)21(17)23/h5-10,12-13H,3-4,11H2,1-2H3