N-(2-methylquinolin-8-yl)-3-[[[(E)-3-phenylprop-2-enyl]amino]methyl]cyclohexane-1-carboxamide

Systemtic Name: N-(2-methylquinolin-8-yl)-3-[[[(E)-3-phenylprop-2-enyl]amino]methyl]cyclohexane-1-carboxamide Openeye Name: 3-[[[(E)-cinnamyl]amino]methyl]-N-(2-methyl-8-quinolyl)cyclohexanecarboxamide CAS Name: N-(2-methyl-8-quinolinyl)-3-[[[(E)-3-phenylprop-2-enyl]amino]methyl]-1-cyclohexanecarboxamide IUPAC Name: N-(2-methylquinolin-8-yl)-3-[[[(E)-3-phenylprop-2-enyl]amino]methyl]cyclohexane-1-carboxamide Traditional Name: 3-[[[(E)-cinnamyl]amino]methyl]-N-(2-methyl-8-quinolyl)cyclohexanecarboxamide Formula: C27H31N3O MolecularWeight: 413.55454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2NC(=O)C3CCCC(C3)CNCC=CC4=CC=CC=C4)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2NC(=O)C3CCCC(C3)CNC/C=C/C4=CC=CC=C4)C=C1

InChI

InChI=1S/C27H31N3O/c1-20-15-16-23-12-6-14-25(26(23)29-20)30-27(31)24-13-5-10-22(18-24)19-28-17-7-11-21-8-3-2-4-9-21/h2-4,6-9,11-12,14-16,22,24,28H,5,10,13,17-19H2,1H3,(H,30,31)/b11-7+