1-[4-[3-[5-fluoranyl-3-(4-methoxyphenyl)carbonyl-2-methyl-indol-1-yl]propyl]piperazin-1-yl]ethanone; methanesulfonic acid

Systemtic Name: 1-[4-[3-[5-fluoranyl-3-(4-methoxyphenyl)carbonyl-2-methyl-indol-1-yl]propyl]piperazin-1-yl]ethanone; methanesulfonic acid Openeye Name: 1-[4-[3-[5-fluoro-3-(4-methoxybenzoyl)-2-methyl-indol-1-yl]propyl]piperazin-1-yl]ethanone; methanesulfonic acid CAS Name: 1-[4-[3-[5-fluoro-3-[(4-methoxyphenyl)-oxomethyl]-2-methyl-1-indolyl]propyl]-1-piperazinyl]ethanone; methanesulfonic acid IUPAC Name: 1-[4-[3-[5-fluoro-3-(4-methoxybenzoyl)-2-methylindol-1-yl]propyl]piperazin-1-yl]ethanone; methanesulfonic acid Traditional Name: 1-[4-[3-(5-fluoro-2-methyl-3-p-anisoyl-indol-1-yl)propyl]piperazino]ethanone; mesylic acid Formula: C27H34FN3O6S MolecularWeight: 547.638763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CCCN3CCN(CC3)C(=O)C)C=CC(=C2)F)C(=O)C4=CC=C(C=C4)OC.CS(=O)(=O)O

Isomeric SMILES

CC1=C(C2=C(N1CCCN3CCN(CC3)C(=O)C)C=CC(=C2)F)C(=O)C4=CC=C(C=C4)OC.CS(=O)(=O)O

InChI

InChI=1S/C26H30FN3O3.CH4O3S/c1-18-25(26(32)20-5-8-22(33-3)9-6-20)23-17-21(27)7-10-24(23)30(18)12-4-11-28-13-15-29(16-14-28)19(2)31;1-5(2,3)4/h5-10,17H,4,11-16H2,1-3H3;1H3,(H,2,3,4)