ethyl 4-[4-[5-(4-fluorophenyl)-2-methyl-1-phenyl-pyrrol-3-yl]carbonylpiperazin-1-yl]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[4-[5-(4-fluorophenyl)-2-methyl-1-phenyl-pyrrol-3-yl]carbonylpiperazin-1-yl]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[4-[5-(4-fluorophenyl)-2-methyl-1-phenyl-pyrrole-3-carbonyl]piperazin-1-yl]-4-oxo-butanoate CAS Name: 4-[4-[[5-(4-fluorophenyl)-2-methyl-1-phenyl-3-pyrrolyl]-oxomethyl]-1-piperazinyl]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[4-[5-(4-fluorophenyl)-2-methyl-1-phenylpyrrole-3-carbonyl]piperazin-1-yl]-4-oxobutanoate Traditional Name: 4-[4-[5-(4-fluorophenyl)-2-methyl-1-phenyl-pyrrole-3-carbonyl]piperazino]-4-keto-butyric acid ethyl ester Formula: C28H30FN3O4 MolecularWeight: 491.553903

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)N1CCN(CC1)C(=O)C2=C(N(C(=C2)C3=CC=C(C=C3)F)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)CCC(=O)N1CCN(CC1)C(=O)C2=C(N(C(=C2)C3=CC=C(C=C3)F)C4=CC=CC=C4)C

InChI

InChI=1S/C28H30FN3O4/c1-3-36-27(34)14-13-26(33)30-15-17-31(18-16-30)28(35)24-19-25(21-9-11-22(29)12-10-21)32(20(24)2)23-7-5-4-6-8-23/h4-12,19H,3,13-18H2,1-2H3