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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3)C4=CC=CC=C4O

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3)C4=CC=CC=C4O

InChI

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