[4-(3-methoxy-4-oxidanyl-phenyl)carbonyloxy-4-oxidanylidene-butanimidoyl] 3-methoxy-4-oxidanyl-benzoate

Systemtic Name: [4-(3-methoxy-4-oxidanyl-phenyl)carbonyloxy-4-oxidanylidene-butanimidoyl] 3-methoxy-4-oxidanyl-benzoate Openeye Name: [4-(4-hydroxy-3-methoxy-benzoyl)oxy-4-oxo-butanimidoyl] 4-hydroxy-3-methoxy-benzoate CAS Name: 4-hydroxy-3-methoxybenzoic acid [4-[(4-hydroxy-3-methoxyphenyl)-oxomethoxy]-1-imino-4-oxobutyl] ester IUPAC Name: [4-(4-hydroxy-3-methoxybenzoyl)oxy-4-oxobutanimidoyl] 4-hydroxy-3-methoxybenzoate Traditional Name: 4-hydroxy-3-methoxy-benzoic acid (4-keto-4-vanilloyloxy-butanimidoyl) ester Formula: C20H19NO9 MolecularWeight: 417.36616

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OC(=N)CCC(=O)OC(=O)C2=CC(=C(C=C2)O)OC)O

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OC(=N)CCC(=O)OC(=O)C2=CC(=C(C=C2)O)OC)O

InChI

InChI=1S/C20H19NO9/c1-27-15-9-11(3-5-13(15)22)19(25)29-17(21)7-8-18(24)30-20(26)12-4-6-14(23)16(10-12)28-2/h3-6,9-10,21-23H,7-8H2,1-2H3