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

Systemtic Name: 2-[4-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperazin-1-yl]phenol Openeye Name: 2-[4-(4-morpholinosulfonyl-2-nitro-phenyl)piperazin-1-yl]phenol CAS Name: 2-[4-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]-1-piperazinyl]phenol IUPAC Name: 2-[4-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)piperazin-1-yl]phenol Traditional Name: 2-[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=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-])C4=CC=CC=C4O

Isomeric SMILES

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

InChI

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