1-[[4-[5-(isoquinolin-1-ylmethyl)-2-methoxy-phenoxy]phenyl]methyl]isoquinoline

Systemtic Name: 1-[[4-[5-(isoquinolin-1-ylmethyl)-2-methoxy-phenoxy]phenyl]methyl]isoquinoline Openeye Name: 1-[[4-[5-(1-isoquinolylmethyl)-2-methoxy-phenoxy]phenyl]methyl]isoquinoline CAS Name: 1-[[4-[5-(1-isoquinolinylmethyl)-2-methoxyphenoxy]phenyl]methyl]isoquinoline IUPAC Name: 1-[[4-[5-(isoquinolin-1-ylmethyl)-2-methoxyphenoxy]phenyl]methyl]isoquinoline Traditional Name: 1-[4-[5-(1-isoquinolylmethyl)-2-methoxy-phenoxy]benzyl]isoquinoline Formula: C33H26N2O2 MolecularWeight: 482.57174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=NC=CC3=CC=CC=C32)OC4=CC=C(C=C4)CC5=NC=CC6=CC=CC=C65

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=NC=CC3=CC=CC=C32)OC4=CC=C(C=C4)CC5=NC=CC6=CC=CC=C65

InChI

InChI=1S/C33H26N2O2/c1-36-32-15-12-24(21-31-29-9-5-3-7-26(29)17-19-35-31)22-33(32)37-27-13-10-23(11-14-27)20-30-28-8-4-2-6-25(28)16-18-34-30/h2-19,22H,20-21H2,1H3