N-(8-methylquinolin-5-yl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-(8-methylquinolin-5-yl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-(8-methyl-5-quinolyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-(8-methyl-5-quinolinyl)-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-(8-methylquinolin-5-yl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-(8-methyl-5-quinolyl)-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C25H25N3O2 MolecularWeight: 399.4849

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)NC(=O)C3CCN(CC3)C(=O)C=CC4=CC=CC=C4)C=CC=N2

Isomeric SMILES

CC1=C2C(=C(C=C1)NC(=O)C3CCN(CC3)C(=O)/C=C/C4=CC=CC=C4)C=CC=N2

InChI

InChI=1S/C25H25N3O2/c1-18-9-11-22(21-8-5-15-26-24(18)21)27-25(30)20-13-16-28(17-14-20)23(29)12-10-19-6-3-2-4-7-19/h2-12,15,20H,13-14,16-17H2,1H3,(H,27,30)/b12-10+