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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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