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

Systemtic Name: N-[3-chloranyl-4-(diethylcarbamoyl)phenyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-[3-chloro-4-(diethylcarbamoyl)phenyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-[3-chloro-4-[diethylamino(oxo)methyl]phenyl]-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-[3-chloro-4-(diethylcarbamoyl)phenyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-[3-chloro-4-(diethylcarbamoyl)phenyl]-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C26H30ClN3O3 MolecularWeight: 467.9877

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H30ClN3O3/c1-3-29(4-2)26(33)22-12-11-21(18-23(22)27)28-25(32)20-14-16-30(17-15-20)24(31)13-10-19-8-6-5-7-9-19/h5-13,18,20H,3-4,14-17H2,1-2H3,(H,28,32)/b13-10+