N-(3-ethyl-2-morpholin-4-yl-pentyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-(3-ethyl-2-morpholin-4-yl-pentyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-(3-ethyl-2-morpholino-pentyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-[3-ethyl-2-(4-morpholinyl)pentyl]-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-(3-ethyl-2-morpholin-4-ylpentyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-(3-ethyl-2-morpholino-pentyl)-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C26H39N3O3 MolecularWeight: 441.60616

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(CNC(=O)C1CCN(CC1)C(=O)C=CC2=CC=CC=C2)N3CCOCC3

Isomeric SMILES

CCC(CC)C(CNC(=O)C1CCN(CC1)C(=O)/C=C/C2=CC=CC=C2)N3CCOCC3

InChI

InChI=1S/C26H39N3O3/c1-3-22(4-2)24(28-16-18-32-19-17-28)20-27-26(31)23-12-14-29(15-13-23)25(30)11-10-21-8-6-5-7-9-21/h5-11,22-24H,3-4,12-20H2,1-2H3,(H,27,31)/b11-10+