4-[[4-[10-[4-(isoquinolin-4-ylmethyl)phenoxy]decoxy]phenyl]methyl]isoquinoline

Systemtic Name: 4-[[4-[10-[4-(isoquinolin-4-ylmethyl)phenoxy]decoxy]phenyl]methyl]isoquinoline Openeye Name: 4-[[4-[10-[4-(4-isoquinolylmethyl)phenoxy]decoxy]phenyl]methyl]isoquinoline CAS Name: 4-[[4-[10-[4-(4-isoquinolinylmethyl)phenoxy]decoxy]phenyl]methyl]isoquinoline IUPAC Name: 4-[[4-[10-[4-(isoquinolin-4-ylmethyl)phenoxy]decoxy]phenyl]methyl]isoquinoline Traditional Name: 4-[4-[10-[4-(4-isoquinolylmethyl)phenoxy]decoxy]benzyl]isoquinoline Formula: C42H44N2O2 MolecularWeight: 608.81096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NC=C2CC3=CC=C(C=C3)OCCCCCCCCCCOC4=CC=C(C=C4)CC5=CN=CC6=CC=CC=C65

Isomeric SMILES

C1=CC=C2C(=C1)C=NC=C2CC3=CC=C(C=C3)OCCCCCCCCCCOC4=CC=C(C=C4)CC5=CN=CC6=CC=CC=C65

InChI

InChI=1S/C42H44N2O2/c1(3-5-11-25-45-39-21-17-33(18-22-39)27-37-31-43-29-35-13-7-9-15-41(35)37)2-4-6-12-26-46-40-23-19-34(20-24-40)28-38-32-44-30-36-14-8-10-16-42(36)38/h7-10,13-24,29-32H,1-6,11-12,25-28H2