2-[3-[(2-methylphenoxy)methyl]pyrrolidin-1-yl]oxy-2-oxidanylidene-ethanoate; 1-methylpyrazin-2-one

Systemtic Name: 2-[3-[(2-methylphenoxy)methyl]pyrrolidin-1-yl]oxy-2-oxidanylidene-ethanoate; 1-methylpyrazin-2-one Openeye Name: 2-[3-[(2-methylphenoxy)methyl]pyrrolidin-1-yl]oxy-2-oxo-acetate; 1-methylpyrazin-2-one CAS Name: 2-[[3-[(2-methylphenoxy)methyl]-1-pyrrolidinyl]oxy]-2-oxoacetate; 1-methyl-2-pyrazinone IUPAC Name: 2-[3-[(2-methylphenoxy)methyl]pyrrolidin-1-yl]oxy-2-oxoacetate; 1-methylpyrazin-2-one Traditional Name: 2-keto-2-[3-[(2-methylphenoxy)methyl]pyrrolidino]oxy-acetate; 1-methylpyrazin-2-one Formula: C19H22N3O6- MolecularWeight: 388.39448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC2CCN(C2)OC(=O)C(=O)[O-].CN1C=CN=CC1=O

Isomeric SMILES

CC1=CC=CC=C1OCC2CCN(C2)OC(=O)C(=O)[O-].CN1C=CN=CC1=O

InChI

InChI=1S/C14H17NO5.C5H6N2O/c1-10-4-2-3-5-12(10)19-9-11-6-7-15(8-11)20-14(18)13(16)17;1-7-3-2-6-4-5(7)8/h2-5,11H,6-9H2,1H3,(H,16,17);2-4H,1H3/p-1