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

Systemtic Name: 1-[4-(4-chloranyl-3-methyl-phenoxy)-3-nitro-phenyl]sulfonylpiperidine Openeye Name: 1-[4-(4-chloro-3-methyl-phenoxy)-3-nitro-phenyl]sulfonylpiperidine CAS Name: 1-[4-(4-chloro-3-methylphenoxy)-3-nitrophenyl]sulfonylpiperidine IUPAC Name: 1-[4-(4-chloro-3-methylphenoxy)-3-nitrophenyl]sulfonylpiperidine Traditional Name: 1-[4-(4-chloro-3-methyl-phenoxy)-3-nitro-phenyl]sulfonylpiperidine Formula: C18H19ClN2O5S MolecularWeight: 410.87186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19ClN2O5S/c1-13-11-14(5-7-16(13)19)26-18-8-6-15(12-17(18)21(22)23)27(24,25)20-9-3-2-4-10-20/h5-8,11-12H,2-4,9-10H2,1H3