sodium 4-methyl-4-(triphenylmethyl)peroxy-pent-2-ynoate

Systemtic Name: sodium 4-methyl-4-(triphenylmethyl)peroxy-pent-2-ynoate Openeye Name: sodium 4-methyl-4-tritylperoxy-pent-2-ynoate CAS Name: sodium 4-methyl-4-(triphenylmethyl)dioxy-2-pentynoate IUPAC Name: sodium 4-methyl-4-tritylperoxypent-2-ynoate Traditional Name: sodium 4-methyl-4-tritylperoxy-pent-2-ynoate Formula: C25H21NaO4 MolecularWeight: 408.42161

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC(=O)[O-])OOC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Na+]

Isomeric SMILES

CC(C)(C#CC(=O)[O-])OOC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Na+]

InChI

InChI=1S/C25H22O4.Na/c1-24(2,19-18-23(26)27)28-29-25(20-12-6-3-7-13-20,21-14-8-4-9-15-21)22-16-10-5-11-17-22;/h3-17H,1-2H3,(H,26,27);/q;+1/p-1