2-[(5-isocyanato-2-methyl-phenyl)carbamoyloxyperoxy]hexanoate

Systemtic Name: 2-[(5-isocyanato-2-methyl-phenyl)carbamoyloxyperoxy]hexanoate Openeye Name: 2-[(5-isocyanato-2-methyl-phenyl)carbamoyloxyperoxy]hexanoate CAS Name: 2-[(5-isocyanato-2-methylanilino)-oxomethoxy]dioxyhexanoate IUPAC Name: 2-[(5-isocyanato-2-methylphenyl)carbamoyloxyperoxy]hexanoate Traditional Name: 2-[(5-isocyanato-2-methyl-phenyl)carbamoyloxyperoxy]hexanoate Formula: C15H17N2O7- MolecularWeight: 337.30468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)[O-])OOOC(=O)NC1=C(C=CC(=C1)N=C=O)C

Isomeric SMILES

CCCCC(C(=O)[O-])OOOC(=O)NC1=C(C=CC(=C1)N=C=O)C

InChI

InChI=1S/C15H18N2O7/c1-3-4-5-13(14(19)20)22-24-23-15(21)17-12-8-11(16-9-18)7-6-10(12)2/h6-8,13H,3-5H2,1-2H3,(H,17,21)(H,19,20)/p-1