2,2-diethyl-1,2-oxaziridin-2-ium-3-one; (2-methylpiperazin-1-yl)-(2,3,4-trimethoxyphenyl)methanone

Systemtic Name: 2,2-diethyl-1,2-oxaziridin-2-ium-3-one; (2-methylpiperazin-1-yl)-(2,3,4-trimethoxyphenyl)methanone Openeye Name: 2,2-diethyloxaziridin-2-ium-3-one; (2-methylpiperazin-1-yl)-(2,3,4-trimethoxyphenyl)methanone CAS Name: 2,2-diethyl-3-oxaziridin-2-iumone; (2-methyl-1-piperazinyl)-(2,3,4-trimethoxyphenyl)methanone IUPAC Name: 2,2-diethyloxaziridin-2-ium-3-one; (2-methylpiperazin-1-yl)-(2,3,4-trimethoxyphenyl)methanone Traditional Name: 2,2-diethyloxaziridin-2-ium-3-one; (2-methylpiperazino)-(2,3,4-trimethoxyphenyl)methanone Formula: C20H32N3O6+ MolecularWeight: 410.48458

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C(=O)O1)CC.CC1CNCCN1C(=O)C2=C(C(=C(C=C2)OC)OC)OC

Isomeric SMILES

CC[N+]1(C(=O)O1)CC.CC1CNCCN1C(=O)C2=C(C(=C(C=C2)OC)OC)OC

InChI

InChI=1S/C15H22N2O4.C5H10NO2/c1-10-9-16-7-8-17(10)15(18)11-5-6-12(19-2)14(21-4)13(11)20-3;1-3-6(4-2)5(7)8-6/h5-6,10,16H,7-9H2,1-4H3;3-4H2,1-2H3/q;+1