(8,9-dimethoxy-6-methyl-2-oxidanylidene-5-phenyl-4,5-dihydro-3H-1-benzoxepin-7-yl) benzoate

Systemtic Name: (8,9-dimethoxy-6-methyl-2-oxidanylidene-5-phenyl-4,5-dihydro-3H-1-benzoxepin-7-yl) benzoate Openeye Name: (8,9-dimethoxy-6-methyl-2-oxo-5-phenyl-4,5-dihydro-3H-1-benzoxepin-7-yl) benzoate CAS Name: benzoic acid (8,9-dimethoxy-6-methyl-2-oxo-5-phenyl-4,5-dihydro-3H-1-benzoxepin-7-yl) ester IUPAC Name: (8,9-dimethoxy-6-methyl-2-oxo-5-phenyl-4,5-dihydro-3H-1-benzoxepin-7-yl) benzoate Traditional Name: benzoic acid (2-keto-8,9-dimethoxy-6-methyl-5-phenyl-4,5-dihydro-3H-1-benzoxepin-7-yl) ester Formula: C26H24O6 MolecularWeight: 432.46516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(CCC(=O)OC2=C(C(=C1OC(=O)C3=CC=CC=C3)OC)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=C2C(CCC(=O)OC2=C(C(=C1OC(=O)C3=CC=CC=C3)OC)OC)C4=CC=CC=C4

InChI

InChI=1S/C26H24O6/c1-16-21-19(17-10-6-4-7-11-17)14-15-20(27)31-23(21)25(30-3)24(29-2)22(16)32-26(28)18-12-8-5-9-13-18/h4-13,19H,14-15H2,1-3H3