N-(3-chloranyl-2,6-diethyl-phenyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-2,6-diethyl-phenyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-(3-chloro-2,6-diethyl-phenyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-(3-chloro-2,6-diethylphenyl)-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-2,6-diethylphenyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-(3-chloro-2,6-diethyl-phenyl)-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C25H29ClN2O2 MolecularWeight: 424.96296

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)C2CCN(CC2)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)C2CCN(CC2)C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C25H29ClN2O2/c1-3-19-11-12-22(26)21(4-2)24(19)27-25(30)20-14-16-28(17-15-20)23(29)13-10-18-8-6-5-7-9-18/h5-13,20H,3-4,14-17H2,1-2H3,(H,27,30)/b13-10+