(4E)-4-[(4-butoxyphenyl)methylidene]-7-methyl-2,3-dihydro-1-benzoxepin-5-one

Systemtic Name: (4E)-4-[(4-butoxyphenyl)methylidene]-7-methyl-2,3-dihydro-1-benzoxepin-5-one Openeye Name: (4E)-4-[(4-butoxyphenyl)methylene]-7-methyl-2,3-dihydro-1-benzoxepin-5-one CAS Name: (4E)-4-[(4-butoxyphenyl)methylidene]-7-methyl-2,3-dihydro-1-benzoxepin-5-one IUPAC Name: (4E)-4-[(4-butoxyphenyl)methylidene]-7-methyl-2,3-dihydro-1-benzoxepin-5-one Traditional Name: (4E)-4-(4-butoxybenzylidene)-7-methyl-2,3-dihydro-1-benzoxepin-5-one Formula: C22H24O3 MolecularWeight: 336.42416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C2CCOC3=C(C2=O)C=C(C=C3)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C/2\CCOC3=C(C2=O)C=C(C=C3)C

InChI

InChI=1S/C22H24O3/c1-3-4-12-24-19-8-6-17(7-9-19)15-18-11-13-25-21-10-5-16(2)14-20(21)22(18)23/h5-10,14-15H,3-4,11-13H2,1-2H3/b18-15+