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

Systemtic Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C25H37N3O2 MolecularWeight: 411.58018

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1(CCCCCC1)CNC(=O)C2CCN(CC2)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CN(C)C1(CCCCCC1)CNC(=O)C2CCN(CC2)C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C25H37N3O2/c1-27(2)25(16-8-3-4-9-17-25)20-26-24(30)22-14-18-28(19-15-22)23(29)13-12-21-10-6-5-7-11-21/h5-7,10-13,22H,3-4,8-9,14-20H2,1-2H3,(H,26,30)/b13-12+