2-(methylamino)ethyl (E)-4-oxidanylidene-4-pentylperoxy-but-2-enoate

Systemtic Name: 2-(methylamino)ethyl (E)-4-oxidanylidene-4-pentylperoxy-but-2-enoate Openeye Name: 2-(methylamino)ethyl (E)-4-oxo-4-pentylperoxy-but-2-enoate CAS Name: (E)-4-oxo-4-pentyldioxy-2-butenoic acid 2-(methylamino)ethyl ester IUPAC Name: 2-(methylamino)ethyl (E)-4-oxo-4-pentylperoxybut-2-enoate Traditional Name: (E)-4-amylperoxy-4-keto-but-2-enoic acid 2-(methylamino)ethyl ester Formula: C12H21NO5 MolecularWeight: 259.29884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOOC(=O)C=CC(=O)OCCNC

Isomeric SMILES

CCCCCOOC(=O)/C=C/C(=O)OCCNC

InChI

InChI=1S/C12H21NO5/c1-3-4-5-9-17-18-12(15)7-6-11(14)16-10-8-13-2/h6-7,13H,3-5,8-10H2,1-2H3/b7-6+