4-[4-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-nitro-phenyl]sulfonylmorpholine

Systemtic Name: 4-[4-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-nitro-phenyl]sulfonylmorpholine Openeye Name: 4-[4-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-nitro-phenyl]sulfonylmorpholine CAS Name: 4-[4-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-3-nitrophenyl]sulfonylmorpholine IUPAC Name: 4-[4-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-nitrophenyl]sulfonylmorpholine Traditional Name: 4-[4-[4-(4-chlorobenzyl)piperazino]-3-nitro-phenyl]sulfonylmorpholine Formula: C21H25ClN4O5S MolecularWeight: 480.965

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)Cl)C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)Cl)C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C21H25ClN4O5S/c22-18-3-1-17(2-4-18)16-23-7-9-24(10-8-23)20-6-5-19(15-21(20)26(27)28)32(29,30)25-11-13-31-14-12-25/h1-6,15H,7-14,16H2