methyl 4-[[5-[4-(pyridin-3-ylmethyl)piperazin-1-yl]carbonylfuran-2-yl]methoxy]benzoate

Systemtic Name: methyl 4-[[5-[4-(pyridin-3-ylmethyl)piperazin-1-yl]carbonylfuran-2-yl]methoxy]benzoate Openeye Name: methyl 4-[[5-[4-(3-pyridylmethyl)piperazine-1-carbonyl]-2-furyl]methoxy]benzoate CAS Name: 4-[[5-[oxo-[4-(3-pyridinylmethyl)-1-piperazinyl]methyl]-2-furanyl]methoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[[5-[4-(pyridin-3-ylmethyl)piperazine-1-carbonyl]furan-2-yl]methoxy]benzoate Traditional Name: 4-[[5-[4-(3-pyridylmethyl)piperazine-1-carbonyl]-2-furyl]methoxy]benzoic acid methyl ester Formula: C24H25N3O5 MolecularWeight: 435.4724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)N3CCN(CC3)CC4=CN=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)N3CCN(CC3)CC4=CN=CC=C4

InChI

InChI=1S/C24H25N3O5/c1-30-24(29)19-4-6-20(7-5-19)31-17-21-8-9-22(32-21)23(28)27-13-11-26(12-14-27)16-18-3-2-10-25-15-18/h2-10,15H,11-14,16-17H2,1H3