1-[4-(2,5-dimethylphenoxy)-3-nitro-phenyl]sulfonylpiperidine

Systemtic Name: 1-[4-(2,5-dimethylphenoxy)-3-nitro-phenyl]sulfonylpiperidine Openeye Name: 1-[4-(2,5-dimethylphenoxy)-3-nitro-phenyl]sulfonylpiperidine CAS Name: 1-[4-(2,5-dimethylphenoxy)-3-nitrophenyl]sulfonylpiperidine IUPAC Name: 1-[4-(2,5-dimethylphenoxy)-3-nitrophenyl]sulfonylpiperidine Traditional Name: 1-[4-(2,5-dimethylphenoxy)-3-nitro-phenyl]sulfonylpiperidine Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N2O5S/c1-14-6-7-15(2)19(12-14)26-18-9-8-16(13-17(18)21(22)23)27(24,25)20-10-4-3-5-11-20/h6-9,12-13H,3-5,10-11H2,1-2H3