[4-(4-methylpiperazin-1-yl)-4-oxidanylidene-butyl] (4-nitrophenyl) carbonate

Systemtic Name: [4-(4-methylpiperazin-1-yl)-4-oxidanylidene-butyl] (4-nitrophenyl) carbonate Openeye Name: [4-(4-methylpiperazin-1-yl)-4-oxo-butyl] (4-nitrophenyl) carbonate CAS Name: carbonic acid [4-(4-methyl-1-piperazinyl)-4-oxobutyl] (4-nitrophenyl) ester IUPAC Name: [4-(4-methylpiperazin-1-yl)-4-oxobutyl] (4-nitrophenyl) carbonate Traditional Name: carbonic acid [4-keto-4-(4-methylpiperazino)butyl] (4-nitrophenyl) ester Formula: C16H21N3O6 MolecularWeight: 351.35444

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CCCOC(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C(=O)CCCOC(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H21N3O6/c1-17-8-10-18(11-9-17)15(20)3-2-12-24-16(21)25-14-6-4-13(5-7-14)19(22)23/h4-7H,2-3,8-12H2,1H3