1-(1H-indol-3-yl)-3-(2-methoxyphenyl)-2-oxidanyl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 1-(1H-indol-3-yl)-3-(2-methoxyphenyl)-2-oxidanyl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 2-hydroxy-1-(1H-indol-3-yl)-3-(2-methoxyphenyl)-3-[4-(2-pyridyl)piperazin-1-yl]propan-1-one CAS Name: 2-hydroxy-1-(1H-indol-3-yl)-3-(2-methoxyphenyl)-3-[4-(2-pyridinyl)-1-piperazinyl]-1-propanone IUPAC Name: 2-hydroxy-1-(1H-indol-3-yl)-3-(2-methoxyphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 2-hydroxy-1-(1H-indol-3-yl)-3-(2-methoxyphenyl)-3-[4-(2-pyridyl)piperazino]propan-1-one Formula: C27H28N4O3 MolecularWeight: 456.53622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(C(C(=O)C2=CNC3=CC=CC=C32)O)N4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

COC1=CC=CC=C1C(C(C(=O)C2=CNC3=CC=CC=C32)O)N4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C27H28N4O3/c1-34-23-11-5-3-9-20(23)25(31-16-14-30(15-17-31)24-12-6-7-13-28-24)27(33)26(32)21-18-29-22-10-4-2-8-19(21)22/h2-13,18,25,27,29,33H,14-17H2,1H3