N-[4-[2-(6-cyano-4,4-dimethyl-1,3-dihydroisoquinolin-2-yl)ethyl]cyclohexyl]quinoline-4-carboxamide

Systemtic Name: N-[4-[2-(6-cyano-4,4-dimethyl-1,3-dihydroisoquinolin-2-yl)ethyl]cyclohexyl]quinoline-4-carboxamide Openeye Name: N-[4-[2-(6-cyano-4,4-dimethyl-1,3-dihydroisoquinolin-2-yl)ethyl]cyclohexyl]quinoline-4-carboxamide CAS Name: N-[4-[2-(6-cyano-4,4-dimethyl-1,3-dihydroisoquinolin-2-yl)ethyl]cyclohexyl]-4-quinolinecarboxamide IUPAC Name: N-[4-[2-(6-cyano-4,4-dimethyl-1,3-dihydroisoquinolin-2-yl)ethyl]cyclohexyl]quinoline-4-carboxamide Traditional Name: N-[4-[2-(6-cyano-4,4-dimethyl-1,3-dihydroisoquinolin-2-yl)ethyl]cyclohexyl]cinchoninamide Formula: C30H34N4O MolecularWeight: 466.61716

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CC2=C1C=C(C=C2)C#N)CCC3CCC(CC3)NC(=O)C4=CC=NC5=CC=CC=C45)C

Isomeric SMILES

CC1(CN(CC2=C1C=C(C=C2)C#N)CCC3CCC(CC3)NC(=O)C4=CC=NC5=CC=CC=C45)C

InChI

InChI=1S/C30H34N4O/c1-30(2)20-34(19-23-10-7-22(18-31)17-27(23)30)16-14-21-8-11-24(12-9-21)33-29(35)26-13-15-32-28-6-4-3-5-25(26)28/h3-7,10,13,15,17,21,24H,8-9,11-12,14,16,19-20H2,1-2H3,(H,33,35)