1-[4-chloranyl-3-[(E)-3-(phenylsulfinyl)prop-1-enyl]phenyl]sulfonylpiperidine

Systemtic Name: 1-[4-chloranyl-3-[(E)-3-(phenylsulfinyl)prop-1-enyl]phenyl]sulfonylpiperidine Openeye Name: 1-[3-[(E)-3-(benzenesulfinyl)prop-1-enyl]-4-chloro-phenyl]sulfonylpiperidine CAS Name: 1-[3-[(E)-3-(benzenesulfinyl)prop-1-enyl]-4-chlorophenyl]sulfonylpiperidine IUPAC Name: 1-[3-[(E)-3-(benzenesulfinyl)prop-1-enyl]-4-chlorophenyl]sulfonylpiperidine Traditional Name: 1-[3-[(E)-3-(benzenesulfinyl)prop-1-enyl]-4-chloro-phenyl]sulfonylpiperidine Formula: C20H22ClNO3S2 MolecularWeight: 423.97658

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C=CCS(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)/C=C/CS(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22ClNO3S2/c21-20-12-11-19(27(24,25)22-13-5-2-6-14-22)16-17(20)8-7-15-26(23)18-9-3-1-4-10-18/h1,3-4,7-12,16H,2,5-6,13-15H2/b8-7+