1-(4-ethylpiperazin-1-yl)-3-[4-[1-(triphenylmethyl)oxypropan-2-yloxy]phenyl]isoquinoline

Systemtic Name: 1-(4-ethylpiperazin-1-yl)-3-[4-[1-(triphenylmethyl)oxypropan-2-yloxy]phenyl]isoquinoline Openeye Name: 1-(4-ethylpiperazin-1-yl)-3-[4-(1-methyl-2-trityloxy-ethoxy)phenyl]isoquinoline CAS Name: 1-(4-ethyl-1-piperazinyl)-3-[4-[1-(triphenylmethyl)oxypropan-2-yloxy]phenyl]isoquinoline IUPAC Name: 1-(4-ethylpiperazin-1-yl)-3-[4-(1-trityloxypropan-2-yloxy)phenyl]isoquinoline Traditional Name: 1-(4-ethylpiperazino)-3-[4-(1-methyl-2-trityloxy-ethoxy)phenyl]isoquinoline Formula: C43H43N3O2 MolecularWeight: 633.82042

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)OC(C)COC(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)OC(C)COC(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C43H43N3O2/c1-3-45-27-29-46(30-28-45)42-40-22-14-13-15-35(40)31-41(44-42)34-23-25-39(26-24-34)48-33(2)32-47-43(36-16-7-4-8-17-36,37-18-9-5-10-19-37)38-20-11-6-12-21-38/h4-26,31,33H,3,27-30,32H2,1-2H3