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

Systemtic Name: N-[4-(3-cyanopyridin-2-yl)oxy-2-methyl-phenyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-[4-[(3-cyano-2-pyridyl)oxy]-2-methyl-phenyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-[4-[(3-cyano-2-pyridinyl)oxy]-2-methylphenyl]-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-[4-(3-cyanopyridin-2-yl)oxy-2-methylphenyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-[4-[(3-cyano-2-pyridyl)oxy]-2-methyl-phenyl]-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C28H26N4O3 MolecularWeight: 466.53104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=C(C=CC=N2)C#N)NC(=O)C3CCN(CC3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=C(C=CC=N2)C#N)NC(=O)C3CCN(CC3)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C28H26N4O3/c1-20-18-24(35-28-23(19-29)8-5-15-30-28)10-11-25(20)31-27(34)22-13-16-32(17-14-22)26(33)12-9-21-6-3-2-4-7-21/h2-12,15,18,22H,13-14,16-17H2,1H3,(H,31,34)/b12-9+