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

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-[(4-dimethylaminophenyl)methyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-[4-(dimethylamino)benzyl]-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C24H29N3O2 MolecularWeight: 391.50596

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC(=O)C2CCN(CC2)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC(=O)C2CCN(CC2)C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C24H29N3O2/c1-26(2)22-11-8-20(9-12-22)18-25-24(29)21-14-16-27(17-15-21)23(28)13-10-19-6-4-3-5-7-19/h3-13,21H,14-18H2,1-2H3,(H,25,29)/b13-10+