(5-chloranyl-2,3-dihydro-1-benzofuran-2-yl)-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: (5-chloranyl-2,3-dihydro-1-benzofuran-2-yl)-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone Openeye Name: (5-chloro-2,3-dihydrobenzofuran-2-yl)-[4-(3-pyridylmethyl)piperazin-1-yl]methanone CAS Name: (5-chloro-2,3-dihydrobenzofuran-2-yl)-[4-(3-pyridinylmethyl)-1-piperazinyl]methanone IUPAC Name: (5-chloro-2,3-dihydro-1-benzofuran-2-yl)-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone Traditional Name: (5-chlorocoumaran-2-yl)-[4-(3-pyridylmethyl)piperazino]methanone Formula: C19H20ClN3O2 MolecularWeight: 357.834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CN=CC=C2)C(=O)C3CC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1CN(CCN1CC2=CN=CC=C2)C(=O)C3CC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C19H20ClN3O2/c20-16-3-4-17-15(10-16)11-18(25-17)19(24)23-8-6-22(7-9-23)13-14-2-1-5-21-12-14/h1-5,10,12,18H,6-9,11,13H2