[4-oxidanylidene-4-(3,4,5-trimethoxyphenyl)but-2-ynyl] 3,4,5-trimethoxybenzoate

Systemtic Name: [4-oxidanylidene-4-(3,4,5-trimethoxyphenyl)but-2-ynyl] 3,4,5-trimethoxybenzoate Openeye Name: [4-oxo-4-(3,4,5-trimethoxyphenyl)but-2-ynyl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [4-oxo-4-(3,4,5-trimethoxyphenyl)but-2-ynyl] ester IUPAC Name: [4-oxo-4-(3,4,5-trimethoxyphenyl)but-2-ynyl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [4-keto-4-(3,4,5-trimethoxyphenyl)but-2-ynyl] ester Formula: C23H24O9 MolecularWeight: 444.43126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)C#CCOC(=O)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)C#CCOC(=O)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C23H24O9/c1-26-17-10-14(11-18(27-2)21(17)30-5)16(24)8-7-9-32-23(25)15-12-19(28-3)22(31-6)20(13-15)29-4/h10-13H,9H2,1-6H3