2-(4-ethoxybutyl)-5-(4-fluorophenyl)-1-(4-methylphenyl)sulfonyl-pyrrolidine

Systemtic Name: 2-(4-ethoxybutyl)-5-(4-fluorophenyl)-1-(4-methylphenyl)sulfonyl-pyrrolidine Openeye Name: 2-(4-ethoxybutyl)-5-(4-fluorophenyl)-1-(p-tolylsulfonyl)pyrrolidine CAS Name: 2-(4-ethoxybutyl)-5-(4-fluorophenyl)-1-(4-methylphenyl)sulfonylpyrrolidine IUPAC Name: 2-(4-ethoxybutyl)-5-(4-fluorophenyl)-1-(4-methylphenyl)sulfonylpyrrolidine Traditional Name: 2-(4-ethoxybutyl)-5-(4-fluorophenyl)-1-tosyl-pyrrolidine Formula: C23H30FNO3S MolecularWeight: 419.552603

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCCC1CCC(N1S(=O)(=O)C2=CC=C(C=C2)C)C3=CC=C(C=C3)F

Isomeric SMILES

CCOCCCCC1CCC(N1S(=O)(=O)C2=CC=C(C=C2)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H30FNO3S/c1-3-28-17-5-4-6-21-13-16-23(19-9-11-20(24)12-10-19)25(21)29(26,27)22-14-7-18(2)8-15-22/h7-12,14-15,21,23H,3-6,13,16-17H2,1-2H3