4-[1-(phenylmethyl)piperidin-4-yl]-4-(quinolin-2-ylmethoxy)cyclohexa-2,5-diene-1-carboxamide

Systemtic Name: 4-[1-(phenylmethyl)piperidin-4-yl]-4-(quinolin-2-ylmethoxy)cyclohexa-2,5-diene-1-carboxamide Openeye Name: 4-(1-benzyl-4-piperidyl)-4-(2-quinolylmethoxy)cyclohexa-2,5-diene-1-carboxamide CAS Name: 4-[1-(phenylmethyl)-4-piperidinyl]-4-(2-quinolinylmethoxy)-1-cyclohexa-2,5-dienecarboxamide IUPAC Name: 4-(1-benzylpiperidin-4-yl)-4-(quinolin-2-ylmethoxy)cyclohexa-2,5-diene-1-carboxamide Traditional Name: 4-(1-benzyl-4-piperidyl)-4-(2-quinolylmethoxy)cyclohexa-2,5-diene-1-carboxamide Formula: C29H31N3O2 MolecularWeight: 453.57534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2(C=CC(C=C2)C(=O)N)OCC3=NC4=CC=CC=C4C=C3)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C2(C=CC(C=C2)C(=O)N)OCC3=NC4=CC=CC=C4C=C3)CC5=CC=CC=C5

InChI

InChI=1S/C29H31N3O2/c30-28(33)24-12-16-29(17-13-24,34-21-26-11-10-23-8-4-5-9-27(23)31-26)25-14-18-32(19-15-25)20-22-6-2-1-3-7-22/h1-13,16-17,24-25H,14-15,18-21H2,(H2,30,33)