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

Systemtic Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-[2-(diethylaminomethyl)benzyl]-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C27H35N3O2 MolecularWeight: 433.5857

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=CC=C1CNC(=O)C2CCN(CC2)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CCN(CC)CC1=CC=CC=C1CNC(=O)C2CCN(CC2)C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C27H35N3O2/c1-3-29(4-2)21-25-13-9-8-12-24(25)20-28-27(32)23-16-18-30(19-17-23)26(31)15-14-22-10-6-5-7-11-22/h5-15,23H,3-4,16-21H2,1-2H3,(H,28,32)/b15-14+