3-[5-fluoranyl-2-(4-methoxyphenyl)-1H-indol-3-yl]-1-(4-piperidin-1-ylcarbonylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[5-fluoranyl-2-(4-methoxyphenyl)-1H-indol-3-yl]-1-(4-piperidin-1-ylcarbonylpiperazin-1-yl)propan-1-one Openeye Name: 3-[5-fluoro-2-(4-methoxyphenyl)-1H-indol-3-yl]-1-[4-(piperidine-1-carbonyl)piperazin-1-yl]propan-1-one CAS Name: 3-[5-fluoro-2-(4-methoxyphenyl)-1H-indol-3-yl]-1-[4-[oxo(1-piperidinyl)methyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-[5-fluoro-2-(4-methoxyphenyl)-1H-indol-3-yl]-1-[4-(piperidine-1-carbonyl)piperazin-1-yl]propan-1-one Traditional Name: 3-[5-fluoro-2-(4-methoxyphenyl)-1H-indol-3-yl]-1-[4-(piperidine-1-carbonyl)piperazino]propan-1-one Formula: C28H33FN4O3 MolecularWeight: 492.585023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)F)CCC(=O)N4CCN(CC4)C(=O)N5CCCCC5

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)F)CCC(=O)N4CCN(CC4)C(=O)N5CCCCC5

InChI

InChI=1S/C28H33FN4O3/c1-36-22-8-5-20(6-9-22)27-23(24-19-21(29)7-11-25(24)30-27)10-12-26(34)31-15-17-33(18-16-31)28(35)32-13-3-2-4-14-32/h5-9,11,19,30H,2-4,10,12-18H2,1H3