4-[5-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-nitro-phenyl]morpholine

Systemtic Name: 4-[5-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-nitro-phenyl]morpholine Openeye Name: 4-[5-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-nitro-phenyl]morpholine CAS Name: 4-[5-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-2-nitrophenyl]morpholine IUPAC Name: 4-[5-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-nitrophenyl]morpholine Traditional Name: 4-[5-[4-(3,4-dimethylphenyl)sulfonylpiperazino]-2-nitro-phenyl]morpholine Formula: C22H28N4O5S MolecularWeight: 460.54652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])N4CCOCC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])N4CCOCC4)C

InChI

InChI=1S/C22H28N4O5S/c1-17-3-5-20(15-18(17)2)32(29,30)25-9-7-23(8-10-25)19-4-6-21(26(27)28)22(16-19)24-11-13-31-14-12-24/h3-6,15-16H,7-14H2,1-2H3