1-[4-(2-methoxy-4-methyl-phenoxy)-3-nitro-phenyl]sulfonylpiperidine

Systemtic Name: 1-[4-(2-methoxy-4-methyl-phenoxy)-3-nitro-phenyl]sulfonylpiperidine Openeye Name: 1-[4-(2-methoxy-4-methyl-phenoxy)-3-nitro-phenyl]sulfonylpiperidine CAS Name: 1-[4-(2-methoxy-4-methylphenoxy)-3-nitrophenyl]sulfonylpiperidine IUPAC Name: 1-[4-(2-methoxy-4-methylphenoxy)-3-nitrophenyl]sulfonylpiperidine Traditional Name: 1-[4-(2-methoxy-4-methyl-phenoxy)-3-nitro-phenyl]sulfonylpiperidine Formula: C19H22N2O6S MolecularWeight: 406.45278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O6S/c1-14-6-8-18(19(12-14)26-2)27-17-9-7-15(13-16(17)21(22)23)28(24,25)20-10-4-3-5-11-20/h6-9,12-13H,3-5,10-11H2,1-2H3