2-[4-(2-morpholin-4-ylsulfonyl-4-nitro-phenyl)piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-(2-morpholin-4-ylsulfonyl-4-nitro-phenyl)piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-(2-morpholinosulfonyl-4-nitro-phenyl)piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[2-(4-morpholinylsulfonyl)-4-nitrophenyl]-1-piperazinyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-(2-morpholin-4-ylsulfonyl-4-nitrophenyl)piperazin-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-(2-morpholinosulfonyl-4-nitro-phenyl)piperazino]-1-pyrrolidino-ethanone Formula: C20H29N5O6S MolecularWeight: 467.53916

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CCN(C1)C(=O)CN2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H29N5O6S/c26-20(23-5-1-2-6-23)16-21-7-9-22(10-8-21)18-4-3-17(25(27)28)15-19(18)32(29,30)24-11-13-31-14-12-24/h3-4,15H,1-2,5-14,16H2