1-[2-(4-chloranyl-2-methyl-5-propan-2-yl-phenoxy)-5-nitro-phenyl]sulfonylpyrrolidine

Systemtic Name: 1-[2-(4-chloranyl-2-methyl-5-propan-2-yl-phenoxy)-5-nitro-phenyl]sulfonylpyrrolidine Openeye Name: 1-[2-(4-chloro-5-isopropyl-2-methyl-phenoxy)-5-nitro-phenyl]sulfonylpyrrolidine CAS Name: 1-[2-(4-chloro-2-methyl-5-propan-2-ylphenoxy)-5-nitrophenyl]sulfonylpyrrolidine IUPAC Name: 1-[2-(4-chloro-2-methyl-5-propan-2-ylphenoxy)-5-nitrophenyl]sulfonylpyrrolidine Traditional Name: 1-[2-(4-chloro-5-isopropyl-2-methyl-phenoxy)-5-nitro-phenyl]sulfonylpyrrolidine Formula: C20H23ClN2O5S MolecularWeight: 438.92502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)Cl)C(C)C)OC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=C(C=C(C(=C1)Cl)C(C)C)OC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H23ClN2O5S/c1-13(2)16-12-19(14(3)10-17(16)21)28-18-7-6-15(23(24)25)11-20(18)29(26,27)22-8-4-5-9-22/h6-7,10-13H,4-5,8-9H2,1-3H3