4-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-nitro-phenyl]sulfonylmorpholine

Systemtic Name: 4-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-nitro-phenyl]sulfonylmorpholine Openeye Name: 4-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-nitro-phenyl]sulfonylmorpholine CAS Name: 4-[4-[4-(2,3-dimethylphenyl)-1-piperazinyl]-3-nitrophenyl]sulfonylmorpholine IUPAC Name: 4-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-nitrophenyl]sulfonylmorpholine Traditional Name: 4-[4-[4-(2,3-dimethylphenyl)piperazino]-3-nitro-phenyl]sulfonylmorpholine Formula: C22H28N4O5S MolecularWeight: 460.54652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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