[4-[2,5-dimethoxy-4-[1-(pyridin-2-ylmethyl)indol-5-yl]phenyl]phenyl] methanesulfonate

Systemtic Name: [4-[2,5-dimethoxy-4-[1-(pyridin-2-ylmethyl)indol-5-yl]phenyl]phenyl] methanesulfonate Openeye Name: [4-[2,5-dimethoxy-4-[1-(2-pyridylmethyl)indol-5-yl]phenyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[2,5-dimethoxy-4-[1-(2-pyridinylmethyl)-5-indolyl]phenyl]phenyl] ester IUPAC Name: [4-[2,5-dimethoxy-4-[1-(pyridin-2-ylmethyl)indol-5-yl]phenyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[2,5-dimethoxy-4-[1-(2-pyridylmethyl)indol-5-yl]phenyl]phenyl] ester Formula: C29H26N2O5S MolecularWeight: 514.59214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2=CC=C(C=C2)OS(=O)(=O)C)OC)C3=CC4=C(C=C3)N(C=C4)CC5=CC=CC=N5

Isomeric SMILES

COC1=CC(=C(C=C1C2=CC=C(C=C2)OS(=O)(=O)C)OC)C3=CC4=C(C=C3)N(C=C4)CC5=CC=CC=N5

InChI

InChI=1S/C29H26N2O5S/c1-34-28-18-26(29(35-2)17-25(28)20-7-10-24(11-8-20)36-37(3,32)33)21-9-12-27-22(16-21)13-15-31(27)19-23-6-4-5-14-30-23/h4-18H,19H2,1-3H3