6-[5-(3-ethoxy-3-oxidanylidene-propyl)-2,4-bis(oxidanyl)phenyl]carbonylcyclohexa-1,3-diene-1-carboxylic acid

Systemtic Name: 6-[5-(3-ethoxy-3-oxidanylidene-propyl)-2,4-bis(oxidanyl)phenyl]carbonylcyclohexa-1,3-diene-1-carboxylic acid Openeye Name: 6-[5-(3-ethoxy-3-oxo-propyl)-2,4-dihydroxy-benzoyl]cyclohexa-1,3-diene-1-carboxylic acid CAS Name: 6-[[5-(3-ethoxy-3-oxopropyl)-2,4-dihydroxyphenyl]-oxomethyl]-1-cyclohexa-1,3-dienecarboxylic acid IUPAC Name: 6-[5-(3-ethoxy-3-oxopropyl)-2,4-dihydroxybenzoyl]cyclohexa-1,3-diene-1-carboxylic acid Traditional Name: 6-[5-(3-ethoxy-3-keto-propyl)-2,4-dihydroxy-benzoyl]cyclohexa-1,3-diene-1-carboxylic acid Formula: C19H20O7 MolecularWeight: 360.3579

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(C=C(C(=C1)C(=O)C2CC=CC=C2C(=O)O)O)O

Isomeric SMILES

CCOC(=O)CCC1=C(C=C(C(=C1)C(=O)C2CC=CC=C2C(=O)O)O)O

InChI

InChI=1S/C19H20O7/c1-2-26-17(22)8-7-11-9-14(16(21)10-15(11)20)18(23)12-5-3-4-6-13(12)19(24)25/h3-4,6,9-10,12,20-21H,2,5,7-8H2,1H3,(H,24,25)