4-[3-nitro-4-[(1-phenylpyrazol-4-yl)methoxy]phenyl]sulfonylmorpholine

Systemtic Name: 4-[3-nitro-4-[(1-phenylpyrazol-4-yl)methoxy]phenyl]sulfonylmorpholine Openeye Name: 4-[3-nitro-4-[(1-phenylpyrazol-4-yl)methoxy]phenyl]sulfonylmorpholine CAS Name: 4-[3-nitro-4-[(1-phenyl-4-pyrazolyl)methoxy]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-nitro-4-[(1-phenylpyrazol-4-yl)methoxy]phenyl]sulfonylmorpholine Traditional Name: 4-[3-nitro-4-[(1-phenylpyrazol-4-yl)methoxy]phenyl]sulfonylmorpholine Formula: C20H20N4O6S MolecularWeight: 444.461

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)OCC3=CN(N=C3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)OCC3=CN(N=C3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O6S/c25-24(26)19-12-18(31(27,28)22-8-10-29-11-9-22)6-7-20(19)30-15-16-13-21-23(14-16)17-4-2-1-3-5-17/h1-7,12-14H,8-11,15H2