ethyl 4-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl-pentyl-amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl-pentyl-amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl-pentyl-amino]-4-oxo-butanoate CAS Name: 4-[[1-[(4-fluorophenyl)methyl]-2-pyrrolyl]methyl-pentylamino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl-pentylamino]-4-oxobutanoate Traditional Name: 4-[amyl-[[1-(4-fluorobenzyl)pyrrol-2-yl]methyl]amino]-4-keto-butyric acid ethyl ester Formula: C23H31FN2O3 MolecularWeight: 402.502243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=CC=CN1CC2=CC=C(C=C2)F)C(=O)CCC(=O)OCC

Isomeric SMILES

CCCCCN(CC1=CC=CN1CC2=CC=C(C=C2)F)C(=O)CCC(=O)OCC

InChI

InChI=1S/C23H31FN2O3/c1-3-5-6-15-26(22(27)13-14-23(28)29-4-2)18-21-8-7-16-25(21)17-19-9-11-20(24)12-10-19/h7-12,16H,3-6,13-15,17-18H2,1-2H3