1-[4-(3,5-dimethoxyphenoxy)-3-nitro-phenyl]sulfonylpiperidine

Systemtic Name: 1-[4-(3,5-dimethoxyphenoxy)-3-nitro-phenyl]sulfonylpiperidine Openeye Name: 1-[4-(3,5-dimethoxyphenoxy)-3-nitro-phenyl]sulfonylpiperidine CAS Name: 1-[4-(3,5-dimethoxyphenoxy)-3-nitrophenyl]sulfonylpiperidine IUPAC Name: 1-[4-(3,5-dimethoxyphenoxy)-3-nitrophenyl]sulfonylpiperidine Traditional Name: 1-[4-(3,5-dimethoxyphenoxy)-3-nitro-phenyl]sulfonylpiperidine Formula: C19H22N2O7S MolecularWeight: 422.45218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=CC(=C1)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-])OC

InChI

InChI=1S/C19H22N2O7S/c1-26-14-10-15(27-2)12-16(11-14)28-19-7-6-17(13-18(19)21(22)23)29(24,25)20-8-4-3-5-9-20/h6-7,10-13H,3-5,8-9H2,1-2H3