methyl 2-[(4-chloranyl-3-oxidanylidene-5-phenyl-1,2-oxazol-2-yl)methyl]-3-morpholin-4-yl-propaneperoxoate hydrochloride

Systemtic Name: methyl 2-[(4-chloranyl-3-oxidanylidene-5-phenyl-1,2-oxazol-2-yl)methyl]-3-morpholin-4-yl-propaneperoxoate hydrochloride Openeye Name: methyl 2-[(4-chloro-3-oxo-5-phenyl-isoxazol-2-yl)methyl]-3-morpholino-propaneperoxoate hydrochloride CAS Name: 2-[(4-chloro-3-oxo-5-phenyl-2-isoxazolyl)methyl]-3-(4-morpholinyl)propaneperoxoic acid methyl ester hydrochloride IUPAC Name: methyl 2-[(4-chloro-3-oxo-5-phenyl-1,2-oxazol-2-yl)methyl]-3-morpholin-4-ylpropaneperoxoate hydrochloride Traditional Name: 2-[(4-chloro-3-keto-5-phenyl-4-isoxazolin-2-yl)methyl]-3-morpholino-peroxypropionic acid methyl ester hydrochloride Formula: C18H22Cl2N2O6 MolecularWeight: 433.28308

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Descriptors Computed from Structure

Canonical SMILES:

COOC(=O)C(CN1CCOCC1)CN2C(=O)C(=C(O2)C3=CC=CC=C3)Cl.Cl

Isomeric SMILES

COOC(=O)C(CN1CCOCC1)CN2C(=O)C(=C(O2)C3=CC=CC=C3)Cl.Cl

InChI

InChI=1S/C18H21ClN2O6.ClH/c1-24-27-18(23)14(11-20-7-9-25-10-8-20)12-21-17(22)15(19)16(26-21)13-5-3-2-4-6-13;/h2-6,14H,7-12H2,1H3;1H