2-ethyl-1-[4-[1-(2-fluorophenyl)-5-(3-methoxyphenyl)-2-methyl-pyrrol-3-yl]carbonylpiperazin-1-yl]hexan-1-one

Systemtic Name: 2-ethyl-1-[4-[1-(2-fluorophenyl)-5-(3-methoxyphenyl)-2-methyl-pyrrol-3-yl]carbonylpiperazin-1-yl]hexan-1-one Openeye Name: 2-ethyl-1-[4-[1-(2-fluorophenyl)-5-(3-methoxyphenyl)-2-methyl-pyrrole-3-carbonyl]piperazin-1-yl]hexan-1-one CAS Name: 2-ethyl-1-[4-[[1-(2-fluorophenyl)-5-(3-methoxyphenyl)-2-methyl-3-pyrrolyl]-oxomethyl]-1-piperazinyl]-1-hexanone IUPAC Name: 2-ethyl-1-[4-[1-(2-fluorophenyl)-5-(3-methoxyphenyl)-2-methylpyrrole-3-carbonyl]piperazin-1-yl]hexan-1-one Traditional Name: 2-ethyl-1-[4-[1-(2-fluorophenyl)-5-(3-methoxyphenyl)-2-methyl-pyrrole-3-carbonyl]piperazino]hexan-1-one Formula: C31H38FN3O3 MolecularWeight: 519.650123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N1CCN(CC1)C(=O)C2=C(N(C(=C2)C3=CC(=CC=C3)OC)C4=CC=CC=C4F)C

Isomeric SMILES

CCCCC(CC)C(=O)N1CCN(CC1)C(=O)C2=C(N(C(=C2)C3=CC(=CC=C3)OC)C4=CC=CC=C4F)C

InChI

InChI=1S/C31H38FN3O3/c1-5-7-11-23(6-2)30(36)33-16-18-34(19-17-33)31(37)26-21-29(24-12-10-13-25(20-24)38-4)35(22(26)3)28-15-9-8-14-27(28)32/h8-10,12-15,20-21,23H,5-7,11,16-19H2,1-4H3