7-[(4-ethylpiperazin-1-yl)methyl]-6-oxidanyl-2-(pyridin-4-ylmethylidene)-1-benzofuran-3-one

Systemtic Name: 7-[(4-ethylpiperazin-1-yl)methyl]-6-oxidanyl-2-(pyridin-4-ylmethylidene)-1-benzofuran-3-one Openeye Name: 7-[(4-ethylpiperazin-1-yl)methyl]-6-hydroxy-2-(4-pyridylmethylene)benzofuran-3-one CAS Name: 7-[(4-ethyl-1-piperazinyl)methyl]-6-hydroxy-2-(pyridin-4-ylmethylidene)-3-benzofuranone IUPAC Name: 7-[(4-ethylpiperazin-1-yl)methyl]-6-hydroxy-2-(pyridin-4-ylmethylidene)-1-benzofuran-3-one Traditional Name: 7-[(4-ethylpiperazino)methyl]-6-hydroxy-2-(4-pyridylmethylene)coumaran-3-one Formula: C21H23N3O3 MolecularWeight: 365.42562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=C(C=CC3=C2OC(=CC4=CC=NC=C4)C3=O)O

Isomeric SMILES

CCN1CCN(CC1)CC2=C(C=CC3=C2OC(=CC4=CC=NC=C4)C3=O)O

InChI

InChI=1S/C21H23N3O3/c1-2-23-9-11-24(12-10-23)14-17-18(25)4-3-16-20(26)19(27-21(16)17)13-15-5-7-22-8-6-15/h3-8,13,25H,2,9-12,14H2,1H3