3-(4-prop-2-enoyloxybutyl)benzene-1,2,4-tricarboxylic acid

Systemtic Name: 3-(4-prop-2-enoyloxybutyl)benzene-1,2,4-tricarboxylic acid Openeye Name: 3-(4-prop-2-enoyloxybutyl)benzene-1,2,4-tricarboxylic acid CAS Name: 3-[4-(1-oxoprop-2-enoxy)butyl]benzene-1,2,4-tricarboxylic acid IUPAC Name: 3-(4-prop-2-enoyloxybutyl)benzene-1,2,4-tricarboxylic acid Traditional Name: 3-(4-acryloyloxybutyl)trimellitic acid Formula: C16H16O8 MolecularWeight: 336.29344

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)OCCCCC1=C(C=CC(=C1C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C=CC(=O)OCCCCC1=C(C=CC(=C1C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C16H16O8/c1-2-12(17)24-8-4-3-5-9-10(14(18)19)6-7-11(15(20)21)13(9)16(22)23/h2,6-7H,1,3-5,8H2,(H,18,19)(H,20,21)(H,22,23)