methyl 2-[[4-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrrol-2-yl]piperidin-1-yl]methyl]morpholine-4-carboxylate

Systemtic Name: methyl 2-[[4-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrrol-2-yl]piperidin-1-yl]methyl]morpholine-4-carboxylate Openeye Name: methyl 2-[[4-[5-(4-fluorophenyl)-4-(4-pyridyl)-1H-pyrrol-2-yl]-1-piperidyl]methyl]morpholine-4-carboxylate CAS Name: 2-[[4-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrrol-2-yl]-1-piperidinyl]methyl]-4-morpholinecarboxylic acid methyl ester IUPAC Name: methyl 2-[[4-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrrol-2-yl]piperidin-1-yl]methyl]morpholine-4-carboxylate Traditional Name: 2-[[4-[5-(4-fluorophenyl)-4-(4-pyridyl)-1H-pyrrol-2-yl]piperidino]methyl]morpholine-4-carboxylic acid methyl ester Formula: C27H31FN4O3 MolecularWeight: 478.558443

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCOC(C1)CN2CCC(CC2)C3=CC(=C(N3)C4=CC=C(C=C4)F)C5=CC=NC=C5

Isomeric SMILES

COC(=O)N1CCOC(C1)CN2CCC(CC2)C3=CC(=C(N3)C4=CC=C(C=C4)F)C5=CC=NC=C5

InChI

InChI=1S/C27H31FN4O3/c1-34-27(33)32-14-15-35-23(18-32)17-31-12-8-20(9-13-31)25-16-24(19-6-10-29-11-7-19)26(30-25)21-2-4-22(28)5-3-21/h2-7,10-11,16,20,23,30H,8-9,12-15,17-18H2,1H3