N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: 1-[(E)-3-phenylprop-2-enoyl]-N-[2-(tetrahydrofuran-2-ylmethylcarbamoyl)phenyl]piperidine-4-carboxamide CAS Name: N-[2-[oxo-(2-oxolanylmethylamino)methyl]phenyl]-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: 1-[(E)-3-phenylacryloyl]-N-[2-(tetrahydrofurfurylcarbamoyl)phenyl]isonipecotamide Formula: C27H31N3O4 MolecularWeight: 461.55274

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=CC=CC=C2NC(=O)C3CCN(CC3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CC(OC1)CNC(=O)C2=CC=CC=C2NC(=O)C3CCN(CC3)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O4/c31-25(13-12-20-7-2-1-3-8-20)30-16-14-21(15-17-30)26(32)29-24-11-5-4-10-23(24)27(33)28-19-22-9-6-18-34-22/h1-5,7-8,10-13,21-22H,6,9,14-19H2,(H,28,33)(H,29,32)/b13-12+