[4-[(3,4-dimethoxyphenyl)methyl]-5-[(4-methoxyphenyl)methoxy]-5-oxidanylidene-pentyl] 4-methanoyl-2-oxidanyl-benzoate

Systemtic Name: [4-[(3,4-dimethoxyphenyl)methyl]-5-[(4-methoxyphenyl)methoxy]-5-oxidanylidene-pentyl] 4-methanoyl-2-oxidanyl-benzoate Openeye Name: [4-[(3,4-dimethoxyphenyl)methyl]-5-[(4-methoxyphenyl)methoxy]-5-oxo-pentyl] 4-formyl-2-hydroxy-benzoate CAS Name: 4-formyl-2-hydroxybenzoic acid [4-[(3,4-dimethoxyphenyl)methyl]-5-[(4-methoxyphenyl)methoxy]-5-oxopentyl] ester IUPAC Name: [4-[(3,4-dimethoxyphenyl)methyl]-5-[(4-methoxyphenyl)methoxy]-5-oxopentyl] 4-formyl-2-hydroxybenzoate Traditional Name: 4-formyl-2-hydroxy-benzoic acid (5-keto-5-p-anisyloxy-4-veratryl-pentyl) ester Formula: C30H32O9 MolecularWeight: 536.56968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COC(=O)C(CCCOC(=O)C2=C(C=C(C=C2)C=O)O)CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)COC(=O)C(CCCOC(=O)C2=C(C=C(C=C2)C=O)O)CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C30H32O9/c1-35-24-10-6-20(7-11-24)19-39-29(33)23(15-21-9-13-27(36-2)28(17-21)37-3)5-4-14-38-30(34)25-12-8-22(18-31)16-26(25)32/h6-13,16-18,23,32H,4-5,14-15,19H2,1-3H3