3-[3-(3,4-dihexoxyphenyl)-3-oxidanylidene-propanoyl]-4-methoxy-benzoic acid

Systemtic Name: 3-[3-(3,4-dihexoxyphenyl)-3-oxidanylidene-propanoyl]-4-methoxy-benzoic acid Openeye Name: 3-[3-(3,4-dihexoxyphenyl)-3-oxo-propanoyl]-4-methoxy-benzoic acid CAS Name: 3-[3-(3,4-dihexoxyphenyl)-1,3-dioxopropyl]-4-methoxybenzoic acid IUPAC Name: 3-[3-(3,4-dihexoxyphenyl)-3-oxopropanoyl]-4-methoxybenzoic acid Traditional Name: 3-[3-(3,4-dihexoxyphenyl)-3-keto-propanoyl]-4-methoxy-benzoic acid Formula: C29H38O7 MolecularWeight: 498.60782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)CC(=O)C2=C(C=CC(=C2)C(=O)O)OC)OCCCCCC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)CC(=O)C2=C(C=CC(=C2)C(=O)O)OC)OCCCCCC

InChI

InChI=1S/C29H38O7/c1-4-6-8-10-16-35-27-15-12-21(19-28(27)36-17-11-9-7-5-2)24(30)20-25(31)23-18-22(29(32)33)13-14-26(23)34-3/h12-15,18-19H,4-11,16-17,20H2,1-3H3,(H,32,33)