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2,6-bis(oxidanylidene)-4-phenethyl-heptane-1,3,5,7-tetracarboxylic acid

2,6-bis(oxidanylidene)-4-phenethyl-heptane-1,3,5,7-tetracarboxylic acid

Systemtic Name:2,6-bis(oxidanylidene)-4-phenethyl-heptane-1,3,5,7-tetracarboxylic acid
Openeye Name:2,6-dioxo-4-phenethyl-heptane-1,3,5,7-tetracarboxylic acid
CAS Name:2,6-dioxo-4-phenethylheptane-1,3,5,7-tetracarboxylic acid
IUPAC Name:2,6-dioxo-4-phenethylheptane-1,3,5,7-tetracarboxylic acid
Traditional Name:2,6-diketo-4-phenethyl-heptane-1,3,5,7-tetracarboxylic acid
Formula: C19H20O10
MolecularWeight: 408.3561
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C(C(=O)CC(=O)O)C(=O)O)C(C(=O)CC(=O)O)C(=O)O


Isomeric SMILES

C1=CC=C(C=C1)CCC(C(C(=O)CC(=O)O)C(=O)O)C(C(=O)CC(=O)O)C(=O)O


InChI

InChI=1S/C19H20O10/c20-12(8-14(22)23)16(18(26)27)11(7-6-10-4-2-1-3-5-10)17(19(28)29)13(21)9-15(24)25/h1-5,11,16-17H,6-9H2,(H,22,23)(H,24,25)(H,26,27)(H,28,29)


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