7-[methoxy(phenyl)methyl]-5-octoxy-9-oxidanylidene-xanthene-2-carboxylic acid

Systemtic Name: 7-[methoxy(phenyl)methyl]-5-octoxy-9-oxidanylidene-xanthene-2-carboxylic acid Openeye Name: 7-[methoxy(phenyl)methyl]-5-octoxy-9-oxo-xanthene-2-carboxylic acid CAS Name: 7-[methoxy(phenyl)methyl]-5-octoxy-9-oxo-2-xanthenecarboxylic acid IUPAC Name: 7-[methoxy(phenyl)methyl]-5-octoxy-9-oxoxanthene-2-carboxylic acid Traditional Name: 9-keto-7-[methoxy(phenyl)methyl]-5-octoxy-xanthene-2-carboxylic acid Formula: C30H32O6 MolecularWeight: 488.57148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C2C(=CC(=C1)C(C3=CC=CC=C3)OC)C(=O)C4=C(O2)C=CC(=C4)C(=O)O

Isomeric SMILES

CCCCCCCCOC1=C2C(=CC(=C1)C(C3=CC=CC=C3)OC)C(=O)C4=C(O2)C=CC(=C4)C(=O)O

InChI

InChI=1S/C30H32O6/c1-3-4-5-6-7-11-16-35-26-19-22(28(34-2)20-12-9-8-10-13-20)18-24-27(31)23-17-21(30(32)33)14-15-25(23)36-29(24)26/h8-10,12-15,17-19,28H,3-7,11,16H2,1-2H3,(H,32,33)