1-morpholin-4-yl-2-[4-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperazin-1-yl]propan-1-one

Systemtic Name: 1-morpholin-4-yl-2-[4-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperazin-1-yl]propan-1-one Openeye Name: 1-morpholino-2-[4-(4-morpholinosulfonyl-2-nitro-phenyl)piperazin-1-yl]propan-1-one CAS Name: 1-(4-morpholinyl)-2-[4-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]-1-piperazinyl]-1-propanone IUPAC Name: 1-morpholin-4-yl-2-[4-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)piperazin-1-yl]propan-1-one Traditional Name: 1-morpholino-2-[4-(4-morpholinosulfonyl-2-nitro-phenyl)piperazino]propan-1-one Formula: C21H31N5O7S MolecularWeight: 497.56514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCOCC1)N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)N1CCOCC1)N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C21H31N5O7S/c1-17(21(27)24-8-12-32-13-9-24)22-4-6-23(7-5-22)19-3-2-18(16-20(19)26(28)29)34(30,31)25-10-14-33-15-11-25/h2-3,16-17H,4-15H2,1H3