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

Systemtic Name: 4-[4-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperazin-1-yl]phenol Openeye Name: 4-[4-(4-morpholinosulfonyl-2-nitro-phenyl)piperazin-1-yl]phenol CAS Name: 4-[4-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]-1-piperazinyl]phenol IUPAC Name: 4-[4-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)piperazin-1-yl]phenol Traditional Name: 4-[4-(4-morpholinosulfonyl-2-nitro-phenyl)piperazino]phenol Formula: C20H24N4O6S MolecularWeight: 448.49276

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)O)C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)O)C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O6S/c25-17-3-1-16(2-4-17)21-7-9-22(10-8-21)19-6-5-18(15-20(19)24(26)27)31(28,29)23-11-13-30-14-12-23/h1-6,15,25H,7-14H2