N-(3-cyclopentylsulfonylphenyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-(3-cyclopentylsulfonylphenyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-(3-cyclopentylsulfonylphenyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-(3-cyclopentylsulfonylphenyl)-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-(3-cyclopentylsulfonylphenyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-(3-cyclopentylsulfonylphenyl)-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C26H30N2O4S MolecularWeight: 466.5924

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3CCN(CC3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3CCN(CC3)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C26H30N2O4S/c29-25(14-13-20-7-2-1-3-8-20)28-17-15-21(16-18-28)26(30)27-22-9-6-12-24(19-22)33(31,32)23-10-4-5-11-23/h1-3,6-9,12-14,19,21,23H,4-5,10-11,15-18H2,(H,27,30)/b14-13+