methyl 1-(4-fluorophenyl)-4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)pyrrolo[3,2-b]pyrrole-5-carboxylate

Systemtic Name: methyl 1-(4-fluorophenyl)-4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)pyrrolo[3,2-b]pyrrole-5-carboxylate Openeye Name: methyl 1-(4-fluorophenyl)-4-[2-oxo-2-(1-piperidyl)ethyl]pyrrolo[3,2-b]pyrrole-5-carboxylate CAS Name: 1-(4-fluorophenyl)-4-[2-oxo-2-(1-piperidinyl)ethyl]-5-pyrrolo[3,2-b]pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-fluorophenyl)-4-(2-oxo-2-piperidin-1-ylethyl)pyrrolo[3,2-b]pyrrole-5-carboxylate Traditional Name: 1-(4-fluorophenyl)-4-(2-keto-2-piperidino-ethyl)pyrrolo[3,2-b]pyrrole-5-carboxylic acid methyl ester Formula: C21H22FN3O3 MolecularWeight: 383.416083

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(N1CC(=O)N3CCCCC3)C=CN2C4=CC=C(C=C4)F

Isomeric SMILES

COC(=O)C1=CC2=C(N1CC(=O)N3CCCCC3)C=CN2C4=CC=C(C=C4)F

InChI

InChI=1S/C21H22FN3O3/c1-28-21(27)19-13-18-17(9-12-24(18)16-7-5-15(22)6-8-16)25(19)14-20(26)23-10-3-2-4-11-23/h5-9,12-13H,2-4,10-11,14H2,1H3