N-[4-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]phenyl]quinoline-2-carboxamide

Systemtic Name: N-[4-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]phenyl]quinoline-2-carboxamide Openeye Name: N-[4-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]phenyl]quinoline-2-carboxamide CAS Name: N-[4-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]phenyl]-2-quinolinecarboxamide IUPAC Name: N-[4-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]phenyl]quinoline-2-carboxamide Traditional Name: N-[4-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]phenyl]quinaldamide Formula: C31H33N3O3 MolecularWeight: 495.61202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CCCCC3=CC=C(C=C3)NC(=O)C4=NC5=CC=CC=C5C=C4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CCCCC3=CC=C(C=C3)NC(=O)C4=NC5=CC=CC=C5C=C4)OC

InChI

InChI=1S/C31H33N3O3/c1-36-29-19-24-16-18-34(21-25(24)20-30(29)37-2)17-6-5-7-22-10-13-26(14-11-22)32-31(35)28-15-12-23-8-3-4-9-27(23)33-28/h3-4,8-15,19-20H,5-7,16-18,21H2,1-2H3,(H,32,35)